THE `40th INTERNATIONAL SYMPOSIUM ON CAPILLARY
Transcription
THE `40th INTERNATIONAL SYMPOSIUM ON CAPILLARY
THE ‘40th INTERNATIONAL SYMPOSIUM ON CAPILLARY CHROMATOGRAPHY’ and THE ‘13th GC×GC SYMPOSIUM’ May 29 – June 03, 2016 Riva del Garda Fierecongressi, Riva del Garda, Italy The ‘M.J.E. Golay Award 2016’ will be presented The ‘Leslie S. Ettre Award 2016’ will be presented The ‘Giorgio Nota Award 2016’ will be presented The ‘John Phillips Award 2016’ will be presented The ‘GCxGC Lifetime Achievement Award 2016’ will be presented The ‘Genzo Shimadzu Best Oral/Poster Award 2016’ will be presented The ‘Richard Sacks Best Poster Award 2016’ will be presented The ‘Springer Best Poster Award 2016’ will be presented - Conference Address - Riva del Garda Fierecongressi Parco Lido I-38066 Riva del Garda, Italy Tel.: Fax: E-mail: Web: +39-0464-520000 (Info Desk) +39-0464-555255 [email protected] http://www.rivadelgardafierecongressi.it - Symposium Office The Symposium Office is located in the entrance hall of the Congress Center. Opening Hours: Sunday, May 29 Monday, May 30 08:30 until 10:00 GC×GC Course 16:00 until 18:00 13 GC×GC Symposium 08:00 until 11:30 13 GC×GC Symposium 16:00 until 20:00 40 ISCC Tuesday, May 31 08:00 until 16:00 and thereafter 08:30 until 16:00 th th th 1 - Posters With the exception of the plenary and key note lectures, all contributions are posters. Posters will not be introduced by oral presentation th For the 40 ISCC, the posters will be shown from Tuesday to Friday (till 11:00). th For the 13 GC×GC, the posters will be shown from Monday to Friday (till 11:00). For discussion, please meet the authors at their numbered poster board at the time indicated in the scientific program. Special stickers to hang up the posters are available at the Registration Desk. The use of pins is not allowed. - Submission of Manuscripts Participants are invited to contribute manuscripts connected to their presented work at the RIVA 2016 Conference for possible publication in either the Journal of Chromatography A with the intention of eventual publication in a Virtual Special Issue (VSI) that is dedicated to the meeting. All manuscripts will be subject to the usual peer reviewing procedure. A Virtual Special Issue implies that all papers will be handled and reviewed as regular submissions to the journal. Once accepted, papers will be published individually in regular issues. A footnote will indicate at which conference the paper was presented, and this will be used for selection and linking to the Virtual Special Issue. The Virtual Special Issue will be prepared and subsequently placed on an individual Journal Special Issue site – with links to the papers on Science Direct. The Preface and photos (with a possibility also for videos, e.g. from the poster sessions) can be added to the Virtual Special Issue resulting in an expanded special issue, not available in the printed version. When preparing your manuscript please carefully follow the journal's Guide to Authors, which you can find on the online submission site: http://ees.elsevier.com/chroma. At the beginning of May you will be invited by Journal of Chromatography A to submit your article via the journal's online submission and reviewing system which is accessible at http://ees.elsevier.com/chroma. To submit: • • • • • Go to: http://ees.elsevier.com/chroma Click on the “Submit Paper” option from the top menu Enter your user name and password (first time users will have to register) After entering the title of your manuscript, please select RIVA 2016 as the ‘Article Type’ Follow the remaining step-by-step instructions to submit your paper Points to note: 2 • The deadline to submit your manuscript for the RIVA 2016 symposium issue of th Journal of Chromatography A is 24 September 2016 • In your cover letter please mention that your manuscript is intended for the RIVA 2016 special issue If you experience any technical problems or have any technical questions during the submission process, please contact Elsevier Author’s Support: [email protected]. If you have any questions on the submission and reviewing process, please contact the Editorial Office: [email protected] Book of Abstracts The book of abstracts will be delivered on a USB upon registration - Badges - Delegates are requested to wear their badges at all times. Failure to do so will result in refusal of admission to the scientific and social activities. Only yellow badges have access to the Scientific Program of GC×GC and blue badges to the Scientific Program of ISCC. Red badges have access only to the exhibition area as booth personnel. Participants registered to the GC×GC short course will receive an additional badge valid only for Sunday MAY 29, 2016. White badges for accompanying persons have no access to the scientific activities. - Coffee Breaks - Coffee and soft drinks will be served in the exhibition hall during the coffee break times only. th The coffee breaks for the 13 GC×GC Symposium (Monday, May 30) will take place on the first floor of the Congress Hall. 3 - Exhibition Exhibition opening hours: Tuesday, May 31 Wednesday, June 01 Thursday, June 02 Friday, June 03 10:00 – 17:30 09:00 – 17:30 09:00 – 17:00 09:00 – 11:00 Exhibiting Companies Agilent Technologies Brechbühler AG Chromaleont DANI Instruments S.p.a. Thermo Fisher Scientific Trajan Vici AG International VUV Analytics Elementar/Isoprime Waters Entech Instruments YMC Est Analytical Zoex Europe Gerstel GmbH & Co. KG GL Sciences B.V. Hamilton Bonaduz AG HTA Ion Bench Labservice Analytica S.r.l. LECO Markes International Merck/Sigma-Aldrich/Supelco PAS Technology Deutschland GmbH Peak Scientific Restek Shimadzu Europa GmbH 4 Publishing Houses Advanstar (LCGC Europe) Chromatography Today Elsevier LAB world Separation Science Springer Technology Networks Tecnoedizioni The Analytical Scientist TKS Teknoscienze/Chemistry Today - Social Program The following program is offered to the delegates: All Days Coffee Breaks offered by the Diamond Sponsor Shimadzu Europa GmbH Sunday, May 29 18:00 GCxGC Course Cocktail offered by Shimadzu Europa GmbH Location: First floor Congress Centre Monday, May 30 19:15 Welcome Reception offered by DANI Instruments Location: Exhibition Hall Tuesday, June 01 21:00 Concert offered by PerkinElmer Inc., Location: Room 1000, Congress Centre 22:15 Cocktail offered by Gerstel GmbH & Co. KG Location: the Congress Centre 18:45 Wine and Cheese offered by Agilent Technologies Location: Hotel Sole, Piazza 3 Novembre, Riva del Garda (TN) Wednesday, June 02 - Company Dinners - Sunday, May 29 19:00 Invited SILEP program Dinner offered by Merck/SigmaAldrich/Supelco Location: Hotel Du Lac et Du Park Please bring your invitation card Thursday, June 02 19.00 Invited Speaker Dinner offered by Shimadzu Europa GmbH Location: Hotel Du Lac et Du Park Please bring your invitation card - Guest Program Guided tours will be organized by Travel Agency Rivatour. The registration and the purchase of the tickets will take place at the Congress Hall Desk. 5 - Travel - Symposium coaches from Riva del Garda to the main Airports will be organized. For reservation and tickets, please contact the Congress Hall desk. - COMMITTEE MEMBERS th - Scientific Committee 40 ISCC Daniel Armstrong (U.S.A.) Carlo Bicchi (Italy) Salvatore Fanali (Italy) Christian Huber (Austria) Hans-Gerd Janssen (The Netherlands) Kyokatsu Jinno (Japan) James Jorgenson (U.S.A.) Robert T. Kennedy (U.S.A.) Milton L. Lee (U.S.A.) Luigi Mondello (Italy) Milos V. Novotny (U.S.A.) Michael Ramsey (U.S.A.) Pat Sandra (Belgium) Frantisek Svec (U.S.A.) Guowang Xu (China) th - Organizing Committee 40 ISCC Flavio Bedini (Italy) Achille Cappiello (Italy) Frank David 6 (Belgium) John Dimandja (USA) Paola Dugo (Italy) Peter Myers (United Kingdom) Albino Sironi (Italy) th - Honorary Committee 40 ISCC Keith D. Bartle (United Kingdom) Carel A. Cramers (The Netherlands) Rudolf E. Kaiser Harold M. McNair Gerhard Schomburg (Germany) (U.S.A.) (Germany) Shigeru Terabe (Japan) Sorin Trestianu (Italy) th - Scientific Committee 13 GC×GC Philip Marriott John Dimandja Hans-Gerd Janssen Luigi Mondello (Australia) (U.S.A.) (The Netherlands) (Italy) John Seeley (U.S.A.) Robert Synovec (U.S.A.) th - Organizing Committee 13 GC×GC Chiara Cordero Frank Dorman Hans-Georg Schmarr Peter Q. Tranchida (Italy) (U.S.A.) (Germany) (Italy) - CHAIRMAN Luigi Mondello Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali Viale Annunziata, University of Messina 98168, Messina, Italy Tel: +39-090-6766536 Fax: +39-090-358220 E-mail: [email protected] Web: www.sepsci.unime.it 7 - LOCAL ORGANIZATION Margherita Barilà ([email protected]) Elisa Giglio ([email protected]) Tel.: +39-334-3612788 Fax: +39-090-9080155 Chromaleont S.r.l. Viale Boccetta, 70, 98122 – Messina, Italy - SPONSORS RIVA 2016 We would like to thank the sponsors for their generous support. DIAMOND SPONSOR Agilent Technologies Shimadzu Europa GmbH PLATINUM SPONSORS Advanstar (LCGC Europe) DANI Instruments S.p.a. Gerstel GmbH & Co. KG PerkinElmer, Inc. Merck/Sigma-Aldrich/Supelco The Analytical Scientist Waters GOLD SPONSOR LECO 8 SILVER SPONSORS Markes International Peak Scientific Zoex Europe BRONZE SPONSORS Aqualis Brechbühler AG CASSS Elementar/Isoprime Hamilton Bonaduz AG JEOL Europe Pfizer Restek Thermo Fisher Scientific VUV Analytics OTHER SPONSOR Ion Bench MSExpertise 9 PUBLISHING HOUSES Advanstar/UBM (LCGC Europe) Chromatography Today Elsevier LABworld Separation Science Springer Technology Networks TecnoEdizioni The Analytical Scientist TKS (Tekno Scienze Publisher) COOPERATING ORGANIZATIONS Association Francophone des Sciences Séparatives Central European Group for Separation Sciences Chinese American Chromatography Association Chromatography and Electrophoresis Group of the Czech Chemical Society Italian Chemical Society Environment Chemistry and Cultural Heritage Division of the Italian Chemical Society Division of Mass Spectrometry of the Italian Chemical Society Interdivisional Group of Food Chemistry of the Italian Chemical Society Interdivisional Group of Separation Science of the Italian Chemical Society Hungarian Society for Separation Sciences Norwegian Chromatographic Group of the Norwegian Chemical Society Separation Science Group Royal Society of Chemistry Separation Science Section of the Societatea de Chimie din Romania Slovenian Chemical Society Sociedad Espagnola dem Cromatografia y Tecnicas Afines The Japanese Society for Chromatographic Sciences Ukranian Chromatographic Society 10 Comprehensive Two-Dimensional Gas Chromatography (GC×GC)Course: Introduction, Advances, Mass Spectrometry and Applications Sunday, May 29, 2016 08:30 – 09:00 On-site registration/Welcome - Room 300 09:00 – 10:00 PRINCIPLES AND INSTRUMENTATIONS John Dimandja Spelman College, Atlanta, GA, United States 10:00 – 10:45 OPTIMIZATION Hans-Gerd Janssen Unilever, Vlaardingen, The Netherlands 10:45 – 11:15 Coffee Break 11:15 – 12:00 DATA ANALYSIS Robert Synovec University of Washington, Seattle, WA, United States 12:00 – 12:45 GC×GC-MS Peter Q. Tranchida University of Messina, Messina, Italy 12:45 – 14:15 Lunch (own arrangement) 14:15 – 15:40 APPLICATIONS Philip Marriott Monash University, Clayton, Australia 15:40 – 16:30 LATEST TRENDS IN GC×GC John Dimandja, Hans-Gerd Janssen, Robert Synovec, Peter Q. Tranchida, Philip Marriott Spelman College, Atlanta, GA, United States, University of Washington, Seattle, WA, United States, University of Messina, Messina, Italy, and Monash University, Clayton, Australia. 16:30 – 17:00 Coffee Break 17:00 – 17:45 Q/A SESSION 17:45 – 18:00 CLOSING REMARKS 18:00 Cocktail offered by Shimadzu Europe GmbH for the GC×GC Course Participants 11 This page has been left intentionally blank 12 SCIENTIFIC PROGRAM 13th GC×GC Monday, May 30, 2016 th 08:30 – 08:40 Opening Address 13 GC×GC and Lifetime Achievement Award Presentation - Room 1000 Chairperson: Philip Marriott Monash University, Clayton, Australia John Dimandja Spelman College, Atlanta, GA, United States Luigi Mondello University of Messina, Messina, Italy 08:40 – 09:05 Award Lecture Chairperson: John Dimandja Spelman College, Atlanta, GA, United States Le.01 COMPREHENSIVE 2D GAS CHROMATOGRAPHY. A 17-YEAR “BALANCE” Luigi Mondello University of Messina, Messina, Italy 09:10 – 10:50 GC×GC Session 1 - FUNDAMENTALS 1Room 1000 Chairperson: John Dimandja Spelman College, Atlanta, GA, United States GC×GC Session 2 - APPLICATIONS – Food 1 - Room 300 + Belvedere Chairperson: Lourdes Ramos Dpt Instrum Anal & Environ Chem - IQOG-CSIC, Madrid, Spain 09:10 Le.02 CHIRALITY, MOLECULAR INTERCONVERSIONS AND OTHER SEPARATIONS AND PROCESSES REVEALED IN COMPREHENSIVE TWODIMENSIONAL GAS CHROMATOGRAPHY SPACE Philip Marriott, Yong Foo Wong, Yada Nolvachai, Chadin Kulsing, Sung-Tong Chin Monash University, Wellington Rd, 3800 Clayton, Australia Le.07 APPLICATION OF TWO DIMENSIONAL GAS CHROMATOGRAPHY TO THE MEASUREMENT OF FATTY ACIDS AND ALKENYL ETHERS IN ANIMAL TISSUES 1 2 Pierluigi Delmonte , Xabier Belaunzaran , John 3 2 Kramer , Noelia Aldai 1 Office of Regulatory Science - Center for Food Safety and Applied Nutrition, Food and Drug Administration, 20740 College Park, MD, United States 2 University of the Basque Country, Avda. Miguel de Unamuno 3, 01006 Vitoria-Gasteiz, Spain 3 Retired from Agriculture and Agri-Food Canada, 93 Stone Road West, N1G 5C9 Guelph, Ontario, Canada 09:30 Le.03 OPTIMISATION IN FLOW-MODULATED COMPREHENSIVE GC×GC WITH FLAME IONISATION AND VACUUM UV DETECTION 1,2 3 Hans-Gerd Janssen , Sjaak de Koning , Larissa 3 Ram 1 Central Analytical Science Unit – Unilever Research Laboratory, P.O. Box 114 A3280, 3130 AC Vlaardigen, Netherlands 2 Analytical-Chemistry Group – University of Amsterdam, Sciece Park 904, 1098 XH, Netherlands 3 Da Vinci, Cairostraat 10, 3047 BC Rotterdam, Netherlands Le.08 CHALLENGES IN TRANSFERING METHODS FROM THERMAL TO DIFFERENTIAL FLOW MODULATED GC×GC-MS/FID: FOOD “OMICS” INVESTIGATIONS 1 2 Chiara Cordero , Stephen E. Reichenbach , 1 1 3 Federico Magagna , Erica Liberto , Luigi Cobelli , 4 4 Armando Miliazza , Matthew Giardina , Carlo 1 Bicchi 1 Dipartimento di Scienza e Tecnologia del Farmaco - University of Turin, Via Pietro Giuria, 9, I-10125 Turin, Italy 2 University of Nebraska , 1400 R Street, 685880115 Lincoln, United States 3 SRA Instruments, Via alla Castellana 3, 20063 Cernusco sul Naviglio (Milan), Italy 4 Agilent Technologies, Cernusco sul Naviglio, 20063 Cernusco sul Naviglio (Milan), Italy 13 09:50 Le.04 CURRENT STATE OF THERMODYNAMICBASED PREDICTIONS OF GC AND GC×GC SEPARATIONS James J. Harynuk, Keisean A. Stevenson Department of Chemistry - University of Alberta, 11227 Saskatchewan Drive, T6G2G2 Edmonton, AB, Canada Le.09 CULTIVAR-SPECIFIC CHANGES OF APPLE METABOLITE PROFILE DURING COLD STORAGE DETERMINED BY GC×GC-QMS Christoph H. Weinert, Mona Ehlers, Carina I. Mack, Björn Egert, Bernhard Trierweiler, Sabine E. Kulling Department of Safety and Quality of Fruit and Vegetables - Max Rubner-Institut, Haid-und-NeuStr. 9, 76131 Karlsruhe, Germany 10:10 Le.05 FAST MULTIPLEXING OF ANALYTICAL PARAMETERS FOR PERFORMANCE IMPROVEMENTS IN GCxGC-TOF MS Laura McGregor, Nick Bukowski, Matthew Edwards, Massimo Santoro, Joe Blanch Markes International, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom Le.10 VOLATILES OF COSTA RICAN PAPAYA (CARICA PAPAYA L.) FRUIT PURÉES ANALYZED BY MULTIDIMENSIONAL GC METHODS 1 2 Hans-Georg Schmarr , Veronika Lieb , Reinhold 2,3 2 Carle , Christof B. Steingass 1 Viticulture and Enology - DLR Rheinpfalz, Breitenweg 71, 67431 Neustadt an der Weinstrasse, Germany 2 Institute of Food Science and Biotechnology University of Hohenheim, Garbenstr. 25, 70599 Hohenheim, Germany 3 Biological Science Department - King Abdulaziz University, P.O. Box 80257, 21589 Jeddah, Saudi Arabia 10:30 Le.06 A METHOD DEVELOPMENT SOFTWARE TOOL FOR COMPREHENSIVE TWO DIMENSIONAL GAS CHROMATOGRAPHY EVALUATED FOR GC×GC-TOFMS 1 2 Mark Merrick , Leonid M. Blumberg , Viatcheslav 1 Artaev 1 Separation Science R&D - LECO Corporation, 3000 Lakeview Avenue R&D, 49085 St. Joseph, MI, United States 2 Advachrom, P.O. Box 1243, 19801 Wilmington, DE, United States Le.11 GCxGC-TOFMS QUANTIFICATION OF THE EXTENDED LIST OF SUSPECTED ALLERGENS AND REGULATED COMPOUNDS IN FRAGRANCE MATERIALS, FROM A CRITICAL CHOICE OF GC×GC PARAMETERS TO AN IMPLEMENTATION FOR A GLOBAL PROGRAM 1 1 Thomas Dutriez , Laetitia Duffour , Diane 1 2 3 Pétermann , Neil Owen , Greg Adamson 1 RAPS Analytical Laboratory - Givaudan, Chemin de la parfumerie 5, 1214 Vernier, Switzerland 2 RAPS Analytical - Givaudan UK Ltd, Kennington Road Ashford Kent, TN24 0LT Ashford, United Kingdom 3 Global Regulatory Affairs, Product Safety & Sustainability - Givaudan Fragrances Corp. 717 Ridgedale Avenue, 07936 East Hanover Ridgedale, United States 10:50-11:20 11:20 – 13:00 11:20 Coffee Break GC×GC Session 3 - FUNDAMENTALS 2 Room 1000 Chairperson: Philip Marriott Monash University, Clayton, Australia GC×GC Session 4 - APPLICATIONS - Food 2Room 300 + Belvedere Chairperson: Hans-Georg Schmarr Viticulture and Enology - Neustadt an der Weinstrasse, Germany Le.12 HYPHENATIONS OF (LOW-)FLOW MODULATION COMPREHENSIVE 2D GC WITH SINGLE QUADRUPOLE, TRIPLE QUADRUPOLE AND HIGH-RESOLUTION TIME-OF-FLIGHT MASS SPECTROMETRY 1 2 Peter Q. Tranchida , Flavio A. Franchina , 2 1 Giorgia Purcaro , Mariarosa Maimone , Simona 1 1,2 Salivo , Luigi Mondello 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, viale Annunziata, 98168 Messina, Italy 2 Chromaleont s.r.l, c/o University of Messina, viale Annunziata, 98168 Messina, Italy Le.17 SCREENING FOR NIAS: THE POTENTIAL OF GC×GC FOR COMPREHENSIVE ANALYSIS OF MIGRANTS FROM FOOD CONTACT MATERIALS Maurus Biedermann Official Food Control Authority - of the Canton of Zurich, Fehrenstrasse 15, 8032 Zurich, Switzerland 14 11:40 Le.13 EXPLODING A PEAK CAPACITY INCREASE RECORD BY USING HYDROGEN CARRIER GAS FOR COMPREHENSIVE TWODIMENSIONAL GAS CHROMATOGRAPHY TIME-OF-FLIGHT MASS SPECTROMETRY 1 1 Jack Cochran , Julie Kowalski , Christopher 1 1 1 Rattray , Amanda Rigdon , Jaap de Zeeuw , 2 Mark Merrick 1 Innovations - Restek Corporation, 110 Benner Circle, 16823, PA Bellefonte, United States 2 LECO, 3000 Lakeview Drive, 49085 St Joseph, United States Le.18 IDENTIFICATION OF COMPOUNDS MIGRATING FROM CONSUMER PRODUCTS USING GC×GC-TOFMS 1 1 Natalie Rosenfelder , Susanne Maier , Uwe 1 2 Lauber , Juergen Wendt 1 Department Consumer Goods - Chemical and Veterinary Investigations Office Stuttgart (CVUAS), Schaflandstr. 3/2, 70736 Fellbach, Germany 2 European Application & Technology Centre LECO, Max-Dohrn-Straße 8-10, 10589 Berlin, Germany 12:00 Le.14 CHARACTERIZATION OF METABOLOME IN DEVELOPMENT OF METABOLIC COMORBIDIS OF PSYCHOSIS BY GC×GC-TOF MS 1 1 Kajetan Trost , Tommi Suvitaival , Outi 2,3 2,4 1 Mantere , Tuula Kieseppä , Ismo Mattila , 5 1 Päivi Pöhö , Tuulia Hyötyläinen , Jaana 2 1 Suvisaari , Matej Oresic 1 Steno Diabetes Center A/S, Niels Steensens Vej 2-4, 2820 Gentofte, Denmark 2 Mental Health Unit - National Institute for Health and Welfare, Mannerheimintie 166 A, 00271 Helsinki, Finland 3 Department of Psychiatry - McGill University, 1033 Pine Avenue West, H3A 1A1 Montréal, QC, Canada 4 Department of Psychiatry - Helsinki University and Helsinki University Hospital, P.O. Box 590, 00029 Helsinki, Finland 5 Faculty of Pharmacy - University of Helsinki, Viikinkaari 5 E, 00014 Helsinki, Finland Le.19 ASSESSMENT OF THE ORGANOHALOGENATED BURDEN IN BIOLOGICAL SAMPLES BY NON-TARGET GC×GC−TOF MS 1 2 Juan Escobar-Arnanz , Xavier Ortiz , Miren 2 2 1 Pena-Abaurrea , Eric Reiner , Lourdes Ramos 1 Dpt Instrum Anal & Environ Chem - IQOG-CSIC, Juan de la Cierva 3, 28006 Madrid, Spain 2 Ontario Ministry of the Environmental and Climate Change, 125 Resources Road, M9P 3V6 Toronto, Canada 12:20 Le.15 EVALUATION OF ORTHOGONALITY ASSESSMENT TOOLS IN GC×GC 1,2 1,3 Jaroslava Jacova , Alzbeta Gardlo , David 1,2 3 1,2 Friedecky , Karel Hron , Tomas Adam , Jean 4,5 Marie D. Dimandja 1 Laboratory of Metabolomics - Palacky University Olomouc, Hnevotinska 5, 779 00 Olomouc, Czech Republic 2 Laboratory for Inherited Metabolic Disorders University Hospital Olomouc, I. P. Pavlova 6, 775 20 Olomouc, Czech Republic 3 Department of Mathematical Analysis and Applications of Mathematics - Palacky University, Faculty of Science, 17. Listopadu 12, 77146 Olomouc, Czech Republic 4 Institute for Bioengineering and Bioscience Georgia Tech, 315 Ferst Dr. NW, 30332 Atlanta, United States 5 Department of Chemistry and Biochemistry Spelman College, Spelman Lane SW, 30314 Atlanta, United States Le.20 PROFILING VOLATILE COMPOUNDS WITH ANALYSIS OF KEY ODORANTS FOR MONITORING TECHNOLOGICAL AND QUALITY CHANGES IN VIRGIN OILS Henryk H. Jelen, Anna Gracka, Malgorzata Majcher Faculty of Food Science and Nutrition - Poznan University of Life Sciences, Wojska Polskiego 31, 60-624 Poznan, Poland 15 12:40 Le.16 ION PEAK DETECTION FOR COMPREHENSIVE MULTIDIMENSIONAL CHROMATOGRAPHY 1 1 Qingping Tao , Chase Heble , Stephen 2,1 2 Reichenbach , Davis W. Rempe , Chiara 3 4 Cordero , Claudia Zini 1 GC Image, LLC, PO Box 57403, 68505-7403 Lincoln, United States 2 Computer Science & Engineering - University of Nebraska, 260 Avery, 68588-0115 Lincoln, United States 3 Universita degli Studi di Torino, Via Pietro Giuria, 9, I-10125 Torino, Italy 4 Universidade Federal do Rio Grande do Sul, Av. Bento Gonçalves, 9500, 91501-970 Porto AlegreRS, Brazil Le.21 ALL ION DIFFERENTIAL ANALYSIS IN PRODUCT CONTROL APPLICATIONS USING COMPREHENSIVE GC×GC/MS Marco Ruijken R&D - MsMetrix, Doornhoecklaan 81, 3601JT maarssen, Netherlands 13:00-14:00 Lunch Break (on your own) 14:00-16:20 GC×GC Session 5: APPLICATIONS – Environmental - Room 1000 Chairperson: James J. Harynuk University of Alberta, Edmonton, Canada GC×GC Session 6: APPLICATIONS – Food/Biological - Room 300 + 100 Chairperson: Hans-Gerd Janssen Unilever, Vlaardigen, Netherlands 14:00 Le.22 ENVIRONMENTAL FORENSIC INVESTIGATION OF WATER QUALITY UTILIZING GC×GC-TOF MS AND GC×GC-HRT TOF MS Frank Dorman Forensic Science - Penn State University, 107 Whitmore Laboratory, 16802 University Park, PA, United States Le.29 GC×GC-(HR)TOFMS IN CANCER RESEARCH 1 1 Romain Pesesse , Pierre-Hughes Stefanuto , 2 2 Virginie Bertrand , Marie-Claire Gillet , Marie3 3 3 Alice Meuwis , Edouard Louis , Renaud Louis , 1 Jean-Francois F. Focant 1 CART, Organic and Biological Analytical Chemistry, Department of Chemistry - University of Liège, Allée du 6 aoùt B6C, B-4130 Liège, Belgium 2 CART, Mammalian Cell Culture Laboratory University of Liège, Allée du 6 aoùt B6C, B-4130 Liège, Belgium 3 University Hospital Center (CHU) - University of Liège, Allée du 6 aoùt B6C, B-4130 Liège, Belgium 14:20 Le.23 STRATEGIES AND TECHNIQUES FOR IDENTIFYING TARGET AND NON-TARGET COMPOUNDS IN ENVIRONMENTAL SAMPLES 1 2 3 Eric J. Reiner , Karl J. Jobst , Liad Haimovici , 3 3 Dave Megson , Alina Muscalu , Miren 3 3 3 PenaAbaurrea , Li Shen , Ralph Ruffolo , Paul 3 Helm 1 University of Toronto, 58 Beaver Bend Cres , ON M9B 5R3 Toronto, Canada 2 Department of Chemistry and Chemical Biology - McMaster University, 1280 Main St W, L8S 4M1 Hamilton, Canada 3 LaSB MOCC, 125 Resources Rd, M9P 3V6 Toronto, Canada Le.30 CHARACTERIZATION OF THE CLINICAL P. AERUGINOSA VOLATILE METABOLOME USING GC×GC-TOFMS 1, 2 Heather D. Bean Christiaan A. Rees , Mavra 2 2 Nasir , Jane E. Hill 1 School of Life Sciences - Arizona State University, PO Box 874501, 85287-4501 Tempe, United States 2 Thayer School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 14:40 Le.24 COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY FOR THE ANALYSIS OF ENVIRONMENTAL CONTAMINANTS: THERMAL- AND VALVE-BASED APPROACHES 1 1 Tadeusz Gorecki , Haleigh Boswell , Matthew 2,1 Edwards 1 Department of Chemistry - University of Waterloo, 200 University Avenue W., N2L 3G1 Waterloo, Ontario, Canada 2 Markes International Ltd, Gwaun Elai MediScience Campus, CF72 8XL Llantrisant, United Kingdom Le.31 URINARY STEROID PROFILING BY COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY/ MASS SPECTROMETRY 1 2 Zhanpin Wu , Bernhard Dick 1 Zoex Corporation, 12221 Fuqua Rd, Suite A, 77034 Houston, United States 2 Department of Nephrology - University of Hospital Bern, Freiburgstrasse 10, 3010 Bern, Switzerland 16 15:00 Le.25 IDENTIFICATION OF PERSISTENT ORGANIC POLLUTANTS IN HOUSEHOLD DUST BY GC×GC/MS USING AN LC/MS INSTRUMENT 1 2 Karl J. Jobst , Eric J. Reiner 1 Department of Chemistry and Chemical Biology - McMaster University, 1280 Main Street West, L8S 4M1 Hamilton, Canada 2 Department of Chemistry - University of Toronto, 80 St. George Street, M5S 3H6 Toronto, Canada Le.32 USING EXHALED BREATH TO DIAGNOSE RESPIRATORY INFECTIONS: APPLYING MULTIDIMENSIONAL CHROMATOGRAPHY COUPLED TO MASS SPECTROMETRY TO THE CLINIC 1 2 3 Jane E. Hill , Heather D. Bean , Edith Zemanick , 4 5 Alix Ashare , Theodore Mellors , Christiaan 5 5 6 Rees , Mavra Nasir , Andrew Black , Boitumelo 6 Maitshotlo 1 School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 2 Arizona State University, 427 East Tyler Mall, 85287 Tempe, United States 3 School of Medicine - University of Colorado, 13123 E 16th Avenue, 80045 Aurora, United States 4 School of Medicine - Dartmouth College, 1 Rope Ferry Rd, 03755 Hanover, United States 5 Thayer School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 6 Wits Reproductive Health and HIV Institute, 22 Esselen St, 2001 Hillbrow, South Africa 15:20 Le.26 ANALYSIS OF RIVER, BOREHOLE AND SWIMMING POOL WATER BY COMPREHENSIVE GAS CHROMATOGRAPHY – TIME OF FLIGHT MASS SPECTROMETRY AND COMPREHENSIVE GAS CHROMATOGRAPHY – HIGH RESOLUTION TIME OF FLIGHT MASS SPECTROMETRY 1 2 Charles P. Gorst-Allman , Yvette Naude 1 Separation Science - LECO Africa (Pty) Ltd, 3 Vuurslag Avenue, 1620 Spartan Ext.7, Kempton, South Africa 2 University of Pretoria, Pretoria, South Africa, 0028 Pretoria, South Africa Le.33 DATA PROCESSING AND IDENTIFICATION WORKFLOW IN BIOMARKER DISCOVERY WITH GC×GC-TOF MS AND GC×GC-HRT TOF MS 1 1 Tuulia Hyötyläinen , Ismo Mattila , Tomás 2 2 2 Kovalczuk , David E. Alonso , Joe Binkley , Matej 3 Oresic 1 Steno Diabetes Center, Niels Steensens Vej 2, 2820 Gentofte, Denmark 2 LECO Corporation, Plaská 66, 323 00 Plzen, Czech Republic 3 Turku Centre for Biotechnology, University of Turku and Åbo Akademi University, Tykistokatu 6, 20520 Turku, Finland 15:40 Le.27 USING GC×GC-MDGC TO FIND TRACE ANALYTES IN ENVIRONMENTAL MATRICES 1 2 Marco Gomes da Silva , Eduardo Mateus Philip 3 Marriott 1 Faculdade de Ciencias e Tecnologia - LAQV, REQUIMTE-DQ, Universidade Nova de Lisboa, 2829-516 Caparica, Portugal 2 CENSE-Center for Environmental and Sustainability Research - DCEA - Universidade Nova de Lisboa, Faculdade de Ciências e Tecnologia, Campus da Caparica, 2829-516 Caparica, Portugal 3 Australian Centre for Research on Separation Science - School of Chemistry, Monash University, Wellington Road, Clayton , VIC 3800 Melboune, Australia Le.34 GC-HRMS AND GC×GC-HRMS FOR THE TARGETED AND UNTARGETED ANALYSIS OF HIGHLY COMPLEX FOOD MATRICES Daniela Peroni Zoex Europe, Tramstraat 15, 5611 CM, Eindhoven, the Netherland JSB Nederland, Apolloweg 2B, 8239DA, Lelystad, the Netherlands 16:00 Le.28 ENVIRONMENT APPLICATION OF GC×GC: ANALYSIS OF PYROLYTIC PRODUCTS DERIVED FROM RESIDUAL BIOMASS 1 1 Elina B. Caramao , Claudia A. Zini , Rosângela 1 2 A. Jacques , Laiza C. Krause , Maria Elisabete 2 1 Machado , Maria Silvana A. Moraes , Débora 1 Tomasini 1 Instituto de Quimica - UFRGS, av.Bento Goncalves,9500, 91510-960 Porto Alegre, Rs, Brazil 2 Unit, av. Murilo Dantas, 300, 49032-490 Aracaju, Brazil Le.35 THE MOLECULAR ORIGINS OF LIFE INVESTIGATED BY GC×GC Uwe J. Meierhenrich Department of Chemistry - Institute de Chimie de Nice, 28, Avenue Valrose, 06108 Nice, France 17 16:20-17:00 Coffee Break – Poster K 17:00-19:03 GC×GC KEYNOTE LECTURES: Young Scientist 1 - Room 1000 Chairperson: Jean-Francois F. Focant University of Liège, Liège, Belgium GC×GC KEYNOTE LECTURES: Young Scientist 2- Room 300 + Belvedere Chairperson: Heather Bean Arizona State University, Tempe, United States 17:00 KNLe.01 MASS SPECTROMETRY AND TWODIMENSIONAL RETENTION INDICES WITH COMPREHENSIVE TWO DIMENSIONAL GAS CHROMATOGRAPHY: AN ADVANCED TOOL FOR PROFILING OF VOLATILE CHEMICALS 1 2 1 Chadin Kulsing , Ming Jiang , Yada Nolvachai , 1 Philip J. Marriott 1 Australian Centre for Research on Separation Science, School of Chemistry - Monash University, Wellington Rd. Clayton, 3800 Melbourne, Australia 2 School of Pharmacy, Tongji Medical College Huazhong University of Science & Technology, #13 Hangkong Road, Wuhan, 430030 Hubei, China KNLe.11 COMPUTATIONAL STRATEGIES FOR MATERIAL SELECTION IN COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY Yada Nolvachai, Chadin Kulsing, Philip J. Marriott Australian Centre for Research on Separation Science, School of Chemistry - Monash University, Wellington Rd., Clayton, 3800 Melbourne, Australia 17:15 KNLe.02 IDENTIFICATION OF ENDOCRINE DISRUPTING CHEMICALS IN WATER BY NOVEL SORPTIVE EXTRACTION, GC×GCTOFMS AND UPLC-MS/MS 1 2 Madelien Wooding , Natalie Aneck-Hahn , Riana 2 1 1 Bornman , Egmont Rohwer , Yvette Naude 1 Department of Chemistry - University of Pretoria, Private bag X20, 0028 Hatfield, South Africa 2 Department of Urology - University of Pretoria, Bophelo Road , 0001 Pretoria, South Africa KNLe.12 DETERMINING THE CAPABILITIES OF ANALYSING CHLORINATED PARAFFINS IN ENVIRONMENTAL MATRICES BY COMPARING CURRENT INSTRUMENTAL TECHNIQUES 1,2 1 Louise van Mourik , Pim E.G. Leonards , 2 1 Caroline Gaus , Jacob de Boer 1 Institute for Environmental Studies (IVM) \ Chemistry & Biology - VU University, De Boelelaan 1087, 1081HV Amsterdam, Netherlands 2 National Research Centre for Environmental Toxicoligy (ENTOX) - University of Queensland, 39 kessels road, 4108 Coopers Plains, Australia 17:27 KNLe.03 DISCRIMINATION BETWEEN INFLAMMATORY BOWEL DISEASE (IBD) PHENOTYPES BY GC×GCHRTOFMS 1 2 Nicolas J. Di Giovanni , Marie-Alice Meuwis , 2 1 Edouard Louis , Jean-Francois Focant 1 MS Laboratory Organic and Biological Analytical Chemistry - ULG, Allée du Six Août B6c, 4000 Liège, Belgium 2 Gastroenterology unit, GIGA-R - CHU, CHU B34 Quartier Hôpital Avenue de l’hopital, 11, 4000 Liège, Belgium KNLe.13 CHARACTERIZATION OF ORGANIC RESIDUES FROM ARCHAEOLOGICAL ARTEFACTS USING GC×GCTOFMS 1 1 Katelynn A. Perrault , Lena Dubois , Pierre1 2 2 Hugues Stefanuto , Dries Cnuts , Veerle Rots , 1 Jean-François Focant 1 Organic and Biological Analytical Chemistry Group - University of Liège, Allée du 6 Août 11, B6c, Quartier Agora, 4000 Liège, Belgium 2 Archéologie préhistorique / Traceolab University of Liège, Quai Roosevelt 1B (Bât. A4), 4000 Liège, Belgium 17:39 KNLe.04 IDENTIFYING VOLATILE BIOMARKERS OF BACTERIAL LUNG INFECTIONS IN CYSTIC FIBROSIS 1 2 Mavra Nasir , Heather D. Bean , Edith T. 3 1 Zemanick , Jane E. Hill 1 Thayer School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 2 School of Life Sciences - Arizona State University, 427 East Tyler Mall, 85287 Tempe, United States 3 School of Life Sciences - University of Colorado, 13123 E 16th Avenue, 80045 Aurora, United States KNLe.14 RETENTION TIME PREDICTION IN FLOWMODULATION COMPREHENSIVE GAS CHROMATOGRAPHY: THE CONTRIBUTION OF PRESSURE ON SOLUTE RETENTION Antoine Burel, Marie Vaccaro, Séverine Tisse, Yohann Cartigny, Valérie Peulon-Agasse, Pascal Cardinael, Gérard Coquerel Laboratoire Sciences et Méthodes Séparatives Normandie Université, Université de Rouen, 1, Rue Tesnière, 76821 MONT SAINT AIGNAN CEDEX, France 18 17:51 KNLe.05 INVESTIGATING THE INTER-INDIVIDUAL VARIATION OF BLOOD ODOUR DETECTED BY BLOOD-DETECTION DOGS UTILISING GC×GC-TOFMS Latara Rust, Katie D. Nizio, Shari L. Forbes Centre for Forensic Science - University of Technology Sydney, PO Box 123, 2007 Sydney, Australia KNLe.15 ON-LINE LIQUID VALVE COUPLED TO GCxGC TECHNIQUE Adrien Maniquet Process Experimentation - IFPEN, Rond point de l'echangeur de Solaize, les levees, 69360 SOLAIZE, France 18:03 KNLe.06 COMBINATION OF GC×GC AND CHEMOMETRICS FOR ODOR-PRINTING IN FORENSIC ANALYSES 1,2 2 Vincent Cuzuel , Guillaume Cognon , Isabelle 3 2 1 Rivals , François Heulard , Didier Thiebaut , 1 Jérôme Vial 1 Department of Analytical, Bioanalytical Sciences and Miniaturization (LSABM) - ESPCI Paris, 10 rue Vauquelin, 75005 PARIS, France 2 Institut de Recherche Criminelle de la Gendarmerie Nationale (IRCGN), 5 boulevard de l'Hautil, 95037 CERGY PONTOISE CEDEX, France 3 Equipe de Statistique Appliquée - ESPCI Paris, 10 rue Vauquelin, 75005 PARIS, France KNLe.16 ARE WE READY FOR A THREE-DIMENSIONAL COMPREHENSIVE ONLINE APPROACH FOR THE ANALYSIS OF COMPLEX PETROCHEMICAL MATRICES? LIQUID CHROMATOGRAPHY COUPLED TO GAS CHROMATOGRAPY COMBINATIONS FOR THE ANALYSIS OF PETROCHEMCIAL MATRICES: AN IN-DEPTH COMPARISON 1 1 Aimee C. Sutherland , Thomas Groger , Jutta 1 1,2 Lintelmann , Ralf Zimmermann 1 Comprehensive Molecular Analytics - Helmholtz Zentrum Muenchen, Ingolstädter Landstraße 1, Building 24, 85764 Munich, Germany 2 Institute of Chemistry - University of Rostock, Dr.-Lorenz-Weg 1, 18051 Rostock, Germany KNLe.07 PRE-PROCESSING OF RAW GC×GC-TOFMS DATA FOR CHEMOMETRIC ANALYSIS Lawrence A. Adutwum, James J. Harynuk Chemistry - University of Alberta, 11227 Saskatchewan Drive, T6G2G2 Edmonton, AB, Canada KNLe.17 SCREENING AND PRIORITIZATION OF WASTE WATER CONTAMINANTS BASED ON GC×GC-MS – AN EVALUATION OF ON-SITE SEWAGE TREATMENT FACILITIES 1 1 Kristin M. Blum , Patrik L. Andersson , Gunno 2 1 Renman , Peter Haglund 1 Department of Chemistry - Umea University, Linneus väg 1, 90187 Umea, Sweden 2 Department of Sustainable Development, Environmental Science and Engineering - KTH Royal Institute of Technology, Teknikringen 76, 10044 Stockholm, Sweden KNLe.08 FEATURE SELECTION AND THE EVALUATION OF EVIDENCE FOR FORENSIC GC×GC-MS COMPARISON 1,2 3 Martin Lopatka , Gabriel Vivo-Truyols , Andjoe 3 4,5 Sampat , Arian van Asten , Peter 3 1,4 Schoenmakers , Marjan Sjerps 1 Korteweg de Vries Institute for Mathematics University of Amsterdam, P.O. Box 94248 , 1090 GE Amsterdam, Netherlands 2 Department of Forensic Chemical Research Netherlands Forensic Institute, P.O. Box 24044, 2490 AA The Hague, Netherlands 3 Van 't Hoff Institute for Molecular Sciences University of Amsterdam, PO Box 94157 , 1090 GD Amsterdam, Netherlands 4 Department of Science, Interdisciplinary Research, Statistics and Knowledge Management (WISK) - Netherlands Forensic Institute, P.O. Box 24044, 2490 AA The Hague, Netherlands 5 Co van Ledden Hulsebosch Center - University of Amsterdam, Science Park – Building 904 , 1098 XH Amsterdam, Netherlands KNLe.18 COMBINED MATHEMATICAL METHODS IN GC-MS DATA ANALYSIS Andrei Barcaru, Gabriel Vivo-Truyols Analytical-Chemistry Group - University of Amsterdam, Science Park 904, 1098 XH Amsterdam, Netherlands 18:15 18:27 19 18:39 KNLe.09 ACHIEVING A NEAR-THEORETICAL MAXIMUM IN PEAK CAPACITY GAIN FOR THE ANALYSIS OF IGNITABLE LIQUIDS USING GC×GC-TOFMS 1 2 Katie D. Nizio , Jack W. Cochran , Shari L. 1 Forbes 1 Centre for Forensic Science - University of Technology Sydney, PO Box 123, 2007 Sydney, Australia 2 Restek Corporation, 110 Benner Circle, 16823 Bellefonte, United States KNLe.19 SOLVING THE CHALLENGE OF SEPARATION AND QUANTIFICATION OF SHORT AND MEDIUM-CHAIN CHLORINATED PARAFFINS IN ENVIRONMENTAL SAMPLES USING GC×GC-ECNI-HRTOF-MS Dan Xia, Lirong Gao, Minghui Zheng State Key Laboratory of Environmental Chemistry and Ecotoxicology - Research Center for EcoEnvironmental Sciences, Chinese Academy of Sciences, No.18, Shuangqing Road, Haidian District, Beijing 100085, China, 100085 Beijing , China 18:51 KNLe.10 SUPERBUGS: HOW TO DIAGNOSE THEM RAPIDLY USING ANALYTICAL CHEMISTRY 1 2 Christiaan A. Rees , Agnieszka Smolinska , 1 3 Mavra Nasir , Paola C. Zucchi , Elizabeth B. 3 4,1 Hirsch , Jane E. Hill 1 Geisel School of Medicine - Dartmouth College, 1 Rope Ferry Road, 03755 Hanover, United States 2 Department of Toxicology - Maastricht University, PO Box 616, 6200 MD Maastricht, Netherlands 3 Department of Pharmacy and Health Systems Sciences - Northeastern University, 360 Huntington Avenue, 02115 Boston, United States 4 Thayer School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States KNLe.20 TOWARDS A RAPID DIAGNOSTIC FOR URINARY TRACT INFECTIONS: BACTERIAL VOLATILES ANALYSIS VIA GC×GC-TOFMS 1 2 Rocco P. Morra , Christiaan A. Rees , Jane E. 1,2 Hill 1 Thayer School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 2 Geisel School of Medicine - Dartmouth College, 1 Rope Ferry Road, 03755 Hanover, United States 19:15 Welcome reception ISCC offered by DANI INSTRUMENTS 20 Tuesday, May 31, 2016 08:45 – 10.20 ISCC Opening Address Award and Opening Lecture See page 25 for details 10:20-10:50 Coffee Break - Exhibition 10:50-12.45 GC×GC Session 7 – FUNDAMENTALS 3 Room 300 + Belvedere Chairperson: Tadeusz Gorecki University of Waterloo, Waterloo, Ontario, Canada ISCC Session 1 - MICROCOLUMN SEPARATIONS - Room 1000 See page 25 for details 10:50-11.00 John Phillips Award Presentation Sponsored by Restek/LECO Giorgio Nota Award Presentation Sponsored by Waters 11:00 Le.36 Phillips Award Lecture METABOLOMICS BY MULTIDIMENSIONAL GCMS APPROACH: ROUTE TO SYSTEMATIC IDENTIFICATION OF VOC BIOMARKERS Sung-Tong Chin Dept of Surgery & Cancer - Imperial College London, St Mary Campus, W2 1NY London, United Kingdom 11:25 Le.37 COMPLEX PROBLEM SOLVING WITH THERMAL INDEPENDENT MODULATOR AND COMPREHENSIVE TWO DIMENSIONAL GAS CHROMATOGRAPHY 1,2 3 Jim Luong , Xiaosheng Guan , Roger 4 1,5 5,6 Firor , Ronda Gras , Robert A. Shellie 1 Analytical Technology Center - Dow Chemical Canada, PO BAG 16, Highway 15, T8L2P4 Fort Saskatchewan, AB, Canada 2 Australian Center for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 3 Agilent Technologies (Ret.), Shanghai, China, 412 Ying Lun Road, 200131 Shanghai, China 4 Agilent Technologies (Ret.) Little Falls, USA, 2850 Centerville Road, 19808 Wilmington, United States 5 ARC Training Centre for Portable Analytical Separation Technologies (ASTech) University of Tasmania, Private Bag 75, 7001 Hobart, Australia 6 Trajan Scientific & Medical, 75 Argent Place, 3134 Ringwood, Australia 11:45 Le.38 A NOVEL CONCEPT IN GC×GC(-MS) SYSTEM OPTIMIZATION AND METHOD TRANSLATION 1 1 2 Zhijun Zhao , Xiaosheng Guan , Jim Luong 1 J&X Technologies, Room 1034, Building 1st, 1599 Jungong Road,Yangpu District, 200438 Shanghai, China 2 Analytical Technology Center (ATC) - Dow Chemical Canada, Highway 15, PO BAG 16, T8L 2P4 Fort Saskatchewan, Canada 21 12:05 Le.39 QUANTIFICATION BASED ON VACUUM ULTRAVIOLET ABSORPTION SPECTROSCOPY (VUV): THE APPLICATION OF COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY - VUV TOWARDS MIDDLE DISTILLATES 1 1 Thomas M. Gröger , Beate Gruber , 2 1,3 Maximilian Jennerwein , Ralf Zimmermann 1 Comprehensive molecular analytics Helmholtzentrum München, Ingolstädter Landstrasse 1, 85764 Oberschleiheim, Germany 2 ASG Analytik-Service Gesellschaft mbH, Trentiner Ring 30, 86356 Neusäß, Germany 3 Analytical Chemsitry - University of Rostock, Dr.-Lorenz-Weg 1, 18051 Rostock, Germany 12:25 Le.40 DEVELOPMENT AND VALIDATION OF A PNEUMATIC CALCULATOR FOR THE REVERSED-FLOW DIFFERENTIAL FLOW MODULATOR FOR COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY Matthew Giardina, James D. McCurry Gas Phase Separations Division - Agilent Technologies, 2850 Centerville Road, 19808 Wilmington, United States 12:45-14:00 14:00 – 15:20 Lunch Break (on your own) GC×GC Session 8 - APPLICATIONS Petrochemical/Industry - Room 300 + Belvedere Chairperson: Robert Shellie University of Tasmania, Hobart, Tasmania, Australia 14:00 Le.41 ANALYSIS OF COMPLEX MIXTURES OF ORGANIC COMPOUNDS FROM COAL OR TYRE PYROLYSIS BY GC×GC-MS Philipp Rathsack Institute of Analytical Chemistry - TU Bergakademie Freiberg, Leipziger Str. 29, 09599 Freiberg, Germany 14:20 Le.42 A PARADIGM SHIFT IN PETROLEOMICS: GC×GC-HRMS, MASS DEFECT PLOTS, DECONVOLUTION AND THEIR ROLE IN SPECIATION Jonathan D. Byer, Joe Binkley LECO Corporation, 3000 Lakeview Avenue, 49085 Saint Joseph, United States 14:40 Le.43 QUALITATIVE AND QUANTITATIVE GC×GC: USING OFF-LINE AND AUTOMATED APPROACHES TO IMPROVE HIGH THROUGHPUT RESEARCH PROJECTS AND MANUFACTURING PROCESSES 1 1 Melissa Dunkle , Pascal Pijcke , Mubasher 1 2 2 Bashir , Murat Palit , Georgios Bellos 1 Analytical Sciences - Dow Benelux, Herbert H. Dowweg 5, 4542 NM Hoek, Netherlands 2 Dow Benelux, Herbert H. Dowweg 5, 4542 NM Hoek, Netherlands ISCC Session 2 - BIO-ANALYTICAL Room 1000 See page 26 for details 22 15:00 Le.44 QUALITATIVE AND QUANTITATIVE SCREENING OF SURFACE AND DRINKING WATERS USING ON-LINE SPE GC×GC-TOF MS 1,2 1 Pieter Joos , Els Van Meenen 1 Laboratory - water-link, Mechelsesteenweg 2 64, 2018 Antwerp, Belgium Department of Bioengineering - University of Antwerp, Groenenborgerlaan 171, 2020 Antwerpen, Belgium 15:20 – 16:50 Coffee Break – Exhibition – Seminars – Posters A, B, L, K* 15:45 – 16:45 Room 1000 Seminar SHIMADZU See page 43 for details 15:45 – 16:45 Room 300 Seminar LECO See page 43 for details Room 100 Seminar ZOEX Europe See page 43 for details 16:50 – 18:30 GC×GC Session 9 - APPLICATIONS Petrochemical - Room 300 + Belvedere Chairperson: Jane Hill Thayer School of Engineering - Dartmouth College, Hanover, United States 16:50 Le.45 OVER THE HUMP, OR OVER THE HILL? GC×GC-MS OF UNRESOLVED COMPLEX MIXTURES FROM PETROLEUM Steven Rowland Biogeochemistry Research Centre University of Plymouth, Drake Circus, PL4 8AA Plymouth, United Kingdom 17:10 Le.46 COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY OF COMPLEX SYNGAS AND CONDENSATES SAMPLES FROM BIOMASS GASIFICATION 1 2 Didier Thiebaut , Etienne Basset , Marianne 2 2 2 Gallardo , Yilmaz Kara , Olivier Guerrini , 1 3 Fanny Hilaire , Patrick Sassiat , Jérôme 3 Vial 1 PECSA-LSABM - ESPCI, 10 Rue Vauquelin, 75005 Paris, France 2 ENGIE Research and Technologies Division, CRIGEN, 93200 Saint Denis la Plaine, France 3 CBI-LSABM - ESPCI, 10 Rue Vauquelin, 75005 Paris, France 17:30 Le.47 AUTOMATED SPE FRACTIONATION COUPLED WITH GC×GC-FID FOR THE CHARACTERIZATION OF GASOILS: ON THE WAY TO ROUTINE ANALYSIS Vincent Souchon, Manuel Ménard, Marjorie Boiron Physics and Analysis Division - Products Characterisation Department - IFP Energies Nouvelles, Rond-point de l'échangeur de Solaize - BP3, 69360 Solaize, France ISCC Session 3 - MICROSCALE LC - Room 1000 See page 27 for details 23 17:50 Le.48 STRUCTURAL CLASSIFICATION AND CHARACTERIZATION OF HEAVY PETROLEUM BASE OIL HYDROCARBONS BY GC×GC-HRTOF/MS 1 2 Anupam Giri , Marion Courtiade , Amandine 2 1 Racaud , Jean-François Focant 1 Department of Chemistry - University of Liège, Allée du 6 août, 11, B6c, Quartier Agora, B-4000 Liège, Belgium 2 Centre de Recherche de Solaize - Total Marketing Services, Chemin du Canal - BP 22, 69360 Solaize, France 18:10 Le.49 COMPARATIVE STUDY OF TRUE BOILING POINT FRACTIONS OF TWO KUWAITI HEAVY CRUDE OILS USING COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY Hassan A. Al-Rabiah, Abdullwahab Al-Hendi, Latifa Al-Ostad, Tahani Al-Shamary, Hisham AlHenayyan, Roaya Khazemi Petroleum Research Centre - Kuwait Institute for Scientific Research, P.O. Box: 24885 Safat, 13109 Kuwait, Kuwait 18.30 – 18.45 Presentation of the Richard Sacks Best Poster Award th Closing Address 13 GC×GC Symposium 18:45 – 20:00 AGILENT TECHNOLOGIES Users Meeting – Room 100 see page 43 for details 21:00 Concert offered by PERKINELMER, Inc., Room 1000, Congress Centre 22:15 Cocktail offered by GERSTEL GmbH & Co. KG, Congress Centre 24 SCIENTIFIC PROGRAM 40th ISCC Tuesday, May 31, 2016 th 08:45 – 09:15 Opening Address 40 ISCC - Room 1000 Luigi Mondello University of Messina, Messina, Italy Aldo Laganà President of the Analytical Chemistry Division of the Italian Chemical Society, Italy Adalberto Mosaner Mayor of Riva del Garda, Italy 09:15 – 09:25 M.J.E. Golay Award Presentation Sponsored by PerkinElmer, Inc. Chairperson: Milos Novotny Department of Chemistry - Indiana University, Bloomington, IN, United States 09:25 – 09:55 LE.01 Award Lecture MULTIDIMENSIONAL GC WITH CHEMOMETRICS: DISTILLING INFORMATION FROM COMPLEX SAMPLES Robert Synovec Chemistry - University of Washington, Box 351700, 98195 Seattle, WA, United States 09:55 – 10:20 LE.02 Opening Lecture ADVANCES IN THE ANALYSIS OF PROTEIN BIOPHARMACEUTICALS THROUGH APPLICATION OF CONTEMPORARY 2D-LC Pat Sandra, Gerd Vanhoenacker, Koen Sandra R.I.C., President Kennedypark 26, 8500 Kortrijk, Belgium 10:20-10:50 Coffee Break - Exhibition 10:50 – 12:45 ISCC Session 1 - MICROCOLUMN SEPARATIONS - Room 1000 Chairperson: Pat Sandra R.I.C., Kortrijk, Belgium GC×GC Session 7 – Fundamentals 3 Room 300 + Belvedere See page 21 for details 10:50 Giorgio Nota Award Presentation Sponsored by Waters John Phillips Award Presentation Sponsored by Restek/LECO 11:00 LE.03 Giorgio Nota Award Presentation DUAL TWO-DIMENSIONAL LC×LC ON A ZWITTERIONIC POLYMETHACRYLATE CAPILLARY COLUMN IN ALTERNATING HILIC / RP MODES IN COMBINATION WITH SHORT C18 COLUMNS Pavel Jandera, Tomas Hajek, Magda Stankova Analytical Chemistry - University of Pardubice, Studentská 573, 532 10 Pardubice, Czech Republic 11:25 LE.04 CAPILLARY UHPLC WITH POROUS GRAPHITIC CARBON James W. Jorgenson, Daniel Lunn Department of Chemistry, CB#3290 University of North Carolina at Chapel Hill, South Rd, 27599 Chapel Hill, United States. 25 11:45 LE.05 POLYMER INCLUSION MEMBRANE BASED MICROFLUIDIC LATERAL FLOW DEVICES FOR DETERMINATION OF AQUEOUS HEAVY METAL IONS Gayan C. Bandara, Sumate Pengpumkiat, Kelly Ramzy, Vince Remcho Department of Chemistry - Oregon State University, 153 Gilbert Hall, 97331 Corvallis, United States 12.05 LE.06 ANALYSIS OF EXTROGENS: A CHALLENGING ISSUE FOR CAPILLARY SEPARATION TECHNIQUES 1 1,2 Salvatore Fanali , Giovanni D'Orazio , 3 Maria Asensio-Ramos , Javier Hernandez2 2 Borges , Miguel Angel Rodrigues-Delgado 1 Institute of Chemical Methodologies Italian National Research Council-C.N.R., Area della Ricerca di Roma I, Via Salaria Km 29,300, 00015 Monterotondo Scalo (Roma), Italy 2 Departamento de Quimica - Universidad de la Laguna (ULL), Avenida Astrofisico Francisco Sanchez, 38206 La Laguna, Tenerife, Spain 3 Instituto Volcanologico de Canarias INVOLCAN, Parque Taoro 22, 38400 Puerto de la Cruz (Tenerife), Spain 12:25 LE.07 RECENT DEVELOPMENTS IN ENANTIOSEPARATION WITH CAPILLARY ELECTROMIGRATION TECHINIQUES Bezhan Chankvetadze Institute of Physical and Analytical Chemistry, School of Exact and Natural Sciences, - Tbilisi State University, Chavchavadze Ave 3,Tbilisi 0179, Georgia 12:45 - 14:00 Lunch Break (on your own) 14:00 - 15:20 ISCC Session 2 - BIO-ANALYTICAL Room 1000 Chairperson: Alejandro Cifuentes Foodomics Lab, CIAL, CSIC, Madrid, Spain 14:00 GC×GC Session 8 - APPLICATIONS Petrochemical/ Industry - Room 300 + Belvedere See page 22 for details LE.08 SEARCHING THE GLYCOME OF HUMAN URINARY EXOSOMES FOR BIOMARKERS Milos Novotny, Guozhang Zou, Solomon G. Gizaw Department of Chemistry - Indiana University, 800 E Kirkwood Avenue, 474054001 Bloomington, IN, United States 26 14:20 LE.09 TOXICITY ASSESSMENT OF CHEMICALS AND NANOMATERIALS EMPLOYING CELL CULTURE MODELS, PROTEOMICS, AND METABOLOMICS 1 1 Christina Ranninger , Matthew S. Boyles , 1 2 Reischl Roland , Rurik Marc , Oliver 2 1 Kohlbacher , Albert Duschl , Christian 1,3 Huber 1 Department of Molecular Biology University of Salzburg, Hellbrunner Strasse 34, 5020 Salzburg, Austria 2 University of Tübungen, Sand 14, 72076 Tübingen, Germany 3 Christian Doppler Laboratory for Biosimilar Characterization, University of Salzburg, Hellbrunner Strasse 34, 5020 Salzburg, Austria 14:40 LE.10 LIPIDOMICS BY DATA-INDEPENDENT WORKFLOWS Michael Laemmerhofer, Agnes Petker, Joerg Schlotterbeck University of Tuebingen - Institute of Pharmaceutical Sciences, Auf der Morgenstelle 8, D-72076 Tuebingen, Germany 15:00 LE.11 LIPIDOMICS STUDY OF STROKE INDUCED BY SMALL VESSEL DISEASE BY 2D(NP/RP)LC-MS/MS Huwei Liu, Li Yang, Yu Bai Beijing National Laboratory for Molecular Sciences Key Laboratory of Bioorganic Chemistry and Molecular Engineering, Institute of Analytical Chemistry, College of Chemsitry and Molecular Engineering Peking University, Zhong Guan Cun, 100871 Beijing, China 15:20 – 16:50 Coffee Break – Exhibition – Seminars – Posters A, B, L, K* 15:45 – 16:45 Room 1000 Seminar SHIMADZU See page 43 for details 15:45 – 16:45 Room 300 Seminar LECO See page 43 for details Room 100 Seminar ZOEX Europe See page 43 for details 16:50 – 18:30 ISCC Session 3 - MICROSCALE LC Room 1000 Chairperson: J.Michael Ramsey University of North Carolina, Chapel Hill, United States GC×GC Session 9 - APPLICATIONS Petrochemical - Room 300 + Belvedere See page 23 for details 27 16:50 LE.12 PROSPECTS FOR NEW PARTICLE SHAPES IN ANALYTICAL AND MICROSCALE SEPARATIONS Gert Desmet Vrije Universiteit Brussel, Dienst CHIS Pleinlaan 2, Brussels, Belgium 17:10 LE.13 A TRULY PORTABLE HPLC USING MICRO COLUMN CARTRIDGES 1 2 Peter Myers , Claire Armstrong , Adham 1 3 3 Ahmed , Peter Dawes , Andrew Minett , 4 David Goodall 1 Department of Chemistry - University of Liverpool, Oxford Street, L69 7ZD Liverpool, United Kingdom 2 University of Liverpool, Oxford Street, L69 7ZD Liverpool, United Kingdom 3 Eprep, 14/35 Dunlop Rd, Victoria 3170 Mulgrave, Australia 4 Paraytec Limited, York House, YO19 5UP York, United Kingdom 17:30 LE.14 ADVANCEMENTS IN LC DIRECT-EIMS: STATE OF THE ART AND APPLICATIONS Achille Cappiello University of Urbino, P. Rinascimento 6, 61029 Urbino, Italy 17:50 LE.15 3D PRINTING IN RAPID DESIGN OF LED ON-CAPILLARY DETECTION DEVICES 1 1,2 Farhan Cecil , Michael C. Breadmore , 1 1,2 Rosanne M. Guijt , Brett Paull , Pavel N. 1,2 3 Nesterenko , Alan Henderson , Andrew A. 4 1 Cole , Mirek Macka 1 School of Physical Sciences and Australian Centre for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 2 ARC Centre of Excellence for Electromaterials Science and School of Physical Sciences - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 3 School of Engineering Sciences University of Tasmania (UTAS), Private Bag 65, 7001 Hobart, Australia 4 School of Physical Sciences - University of Tasmania (UTAS), Private Bag 37, 7001 Hobart, Australia 18:10 LE.16 NANO-LCMS OF HISTONES USING CAPILLARIES PACKED WITH 0.5 um PARTICLES Mary Wirth Department of Chemistry - Purdue University, 560 Oval Drive, 47907 West Lafayette, IN, United States 18:45 – 20:00 AGILENT TECHNOLOGIES Users Meeting – Room 100 see page 43 for details 21:00 Concert offered by PERKINELMER, Inc., Room 1000, Congress Centre 22:15 Cocktail offered by GERSTEL GmbH & Co. KG, Congress Centre 28 Wednesday, June 01, 2016 08:30 – 10:30 ISCC Session 4 - CAPILLARY GC 1 Room 1000 Chairperson: Carlo Bicchi University of Turin, Turin, Italy ISCC Session 5 - MICRO LC 1 - Room 300 08:30 LE.17 MICROCHIP THERMAL GRADIENT GAS CHROMATOGRAPHY 1 1 Milton L. Lee , Abhijit Ghosh , Luke T. 1 2 Tolley , Aaron R. Hawkins , Brian D. 3 4 Iverson , H. Dennis Tolley 1 Chemistry and Biochemistry - Brigham Young University, C-267 BNSN, 84602 Provo, UT, United States 2 Computer and Electrical Engineering Brigham Young University, 435B CB, 84602 Provo, UT, United States 3 Mechanical Engineering - Brigham Young University, 435 CTB, 84602 Provo, UT, United States 4 Statistics - Brigham Young University, 223 J TMCB, 84602 Provo, UT, United States LE.23 TOWARDS THE DEVELOPMENT OF A MICROFLUIDIC CHIP PLATFORM FOR ION-EXCHANGE SEPARATIONS 1 2 Sam Wouters , Sebastiaan Eeltink 1 Department of Chemical Engineering - Vrije Universiteit Brussel, Pleinlaan 2, B-1050 Brussels, Belgium 2 Vrije Universiteit Brussel, Pleinlaan 2, B1050 Brussels, Belgium 08:50 LE.18 IS CAPILLARY GC A VIABLE TECHNIQUE FOR RESEARCH IN LIFE SCIENCES? Frank David, Pat Sandra, Koen Sandra R.I.C., President Kennedypark 26, 8500 Kortrijk, Belgium LE.24 CHIP-BASED SEPARATION DEVICES COUPLED TO MASS SPEC Detlev Belder, Josef Heiland, Carsten Lotter Department of Chemistry - University of Leipzig, Johannisallee 29, 04103 Leipzig, Germany 09:10 LE.19 APPLICATIONS AND PERSPECTIVES OF FLOW FIELD THERMAL GRADIENT GAS CHROMATOGRAPHY Peter Boeker Workgroup on Trace Gas Measurements University of Bonn, Nussallee 5, D-53115 Bonn, Germany LE.25 ONLINE CAPILLARY LC WITH ONE MINUTE TIME RESOLUTION FOR NEUROTRANSMITTER DETERMINATIONS BY MICRODIALYSIS: OPTIMIZATION AND APPLICATION OF ACTIVE TEMPERATURE CONTROL Khanh Ngo, Stephen R. Groskreutz, Stephen G. Weber Department of Chemistry - University of Pittsburgh, 219 Parkman Drive, 15260 Pittsburgh, PA, United States 09:30 LE.20 TIME INTERVAL DECONVOLUTION OF POLYCHLORINATED BIPHENYLS IN ARACLOR MIXTURES USING GAS CHROMATOGRAPHY - VACUUM ULTRAVIOLET SPECTROSCOPY 1 1 Kevin A. Schug , Changling Qiu , Jonathan 2 2 3 Smuts , Phillip Walsh , Jack Cochran 1 Chemistry and Biochemistry - University of Texas at Arlington, 700 Planetarium PI., Box 19065, TX 76019-0065 Arlington, United States 2 VUV Analytics, 715 Discovery Blvd Suite 502, 78613 Cedar Park, United States 3 Restek Corporation, 110 Benner Circle, 16823 Bellefonte, United States LE.26 HIGH PERFORMANCE MICROSCALE SEPARATIONS USING SPECIFIC INTERACTIONS Takuya Kubo, Madoka Tsuzuki, Eisuke Kanao, Toyohiro Naito, Koji Otsuka Department of Material Chemistry, Graduate School of Engineering - Kyoto University, Katsura, Nishikyo-ku, 6158510 Kyoto, Japan Chairperson: Frantisek Svec Lawrence Berkeley Nat. Lab., Berkeley, United States 29 09:50 LE.21 EVALUATING THE UNIQUE SELECTIVITY OF IONIC LIQUID CAPILLARY COLUMNS Len Sidisky, Gustavo Serrano, James L. Desorcie, Greg A. Baney, Katherine K. Stenerson, Michael Halpenny, Michael D. Buchanan Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States LE.27 CHEMISTRY-SENSITIZED LC-MS/MS OF TRACE BIO-FUNCTIONAL ORGANIC ACIDS IN SUB-MICROGRAM FRESH PLANT SAMPLES Yi Chen Institute of Chemistry - Chinese Academy of Sciences, North 1str. No.2, Zhonguancun, Haidian, 100190 Beijing, China 10:10 LE.22 3D PRINTED CAPILLARY COLUMNS Roy Lautamo, William Bromps Restek West - Restek Corporation, 4211-C Business Drive, 95682 Cameron Park, CA, United States LE.28 OPEN TUBULAR LIQUID CHROMATOGRAPHY-MASS SPECTROMETRY: A TOOL FOR CANCER BIOMARKER DISCOVERY IN ULTRASMALL SAMPLES Steven Wilson, Tore Vehus, Hanne Roberg Larsen, Ole Kristian Brandtzaeg, Elsa Lundanes University of Oslo, Sem Saelands vei 23, Blindern, 561 Oslo, Norway 10:30 – 12:00 Coffee Break – Seminars – Exhibition – Posters C, D, I 10:45 – 11:45 Room 1000 Seminar Room 300 Seminar AGILENT TECHNOLOGIES See page 44 for detail DANI INSTRUMENTS See page 44 for details Room 100 Seminar PEAK SCIENTIFIC See page 44 for details 12:00 – 14:00 Lunch Break (on your own) 11:45 – 12:45 Room 1000 Lunch Seminar WATERS See page 44 for details Room 300 Seminar MARKES INTERNATIONAL See page 44 for details Room 100 ELEMENTAR/ISOPRIME See page 45 for details 14:00 – 15:40 14:00 ISCC Session 6 - CAPILLARY GC-MS Room 1000 Chairperson: Kevin A. Schug Chemistry and Biochemistry - University of Texas at Arlington, Arlington, United States ISCC Session 7 - SAMPLE PREPARATION 1 - Room 300 Chairperson: Fernando M. Lancas Institute of Chemistry at Sao Carlos University of Sao Paulo, Sao Carlos, Brazil LE.29 GC-MS WITH COLD EI AND ITS UNEXPECTED BENEFITS Aviv Amirav, Alexander B. Fialkov, Tal Alon, Uri Keshet Department of Chemistry - Tel Aviv University, Ramat Aviv, 69978 Tel Aviv, Israel LE.34 DEVELOPMENT AND APPLICATION OF MATRIX COMPATIBLE SPME TECHNOLOGY Janusz Pawliszyn Chemistry Department - University of Waterloo, 200 University Avenue West, N2L 3G1 Waterloo, ON, Canada 30 14:20 LE.30 GC-MS IN THE FIELD WITHOUT A SHERPA Edgar Lee, Nathan L. Porter, Tai V. Truong Portable MS/GCMS - PerkinElmer, 796 East Utah Valley Drive, 84003 American Fork, United States LE.35 GREEN FOODOMICS: NEW APPROACHES FOR THE ISOLATION AND PURIFICATION OF BIOACTIVE COMPOUNDS WITH ANTIPROLIFERATIVE ACTIVITY USING GREEN TECHNOLOGIES Andrea del Pilar Sánchez-Camargo, Miguel Herrero, Lidia Montero, Jose A. Mendiola, Virginia García-Cañas, Alejandro Cifuentes, Elena Ibanez Instituto de Investigación en Ciencias de la Alimentación-CIAL (CSIC), c/Nicolas Cabrera 9, 28049 Madrid, Spain 14:40 LE.31 EXTENDING THE APPLICABILITY OF VACUUM-OUTLET GC/MS Erwin Rosenberg, Chrysoula Kanakaki Institute of Chemical Technologies and Analytics - Vienna University of Technology, Getreidemarkt 9/164 AC, A-1060 Vienna, Austria LE.36 CONSIDERATIONS ON MICROEXTRACTION TECHNIQUES ADVANTAGES, LIMITATIONS AND FUTURE TRENDS José M.F. Nogueira Centro de Química e Bioquímica - Faculdade de Ciências, Universidade de Lisboa, Campo Grande Ed. C8, 1749-016 Lisboa, Portugal 15:00 LE.32 HYPHENATION OF GC AND APCI-FTICR-MS FOR ANALYSIS OF PYROLYSIS OILS FROM A GERMAN BROWN COAL Jan Zuber, Marius Kroll, Philipp Rathsack, Matthias Otto Faculty of Chemistry and Physics - Institute of Analytical Chemistry, Leipziger Strasse 29, 09599 Freiberg, Germany LE.37 ON-LINE SAMPLE PREPARATION IN MINIATURIZED SEPARATION TECHNIQUES Michal Szumski, Damian Grzywinski, Kinga Meller, Boguslaw Buszewski Department of Environmental Chemistry and Bioanalytics - Faculty of Chemistry, Nicolaus Copernicus University in Torun, Gagrin 7 St., 87-100 Torun, Poland 15:20 LE.33 ORBITRAP GC-MS: ONE YEAR ON Dominic Roberts, Paul Silcock, Cristian Cojocariu, Jason Cole, Fausto Pigozzo GC-MS - Thermo Fisher Scientific, Tudor Road, WA7 1TA Runcorn, United Kingdom LE.38 SOLVENT-ASSISTED STIR BAR SORPTIVE EXTRACTION (SA-SBSE) FOR ENHANCED RECOVERIES OF POLAR SOLUTES IN AQUEOUS SAMPLES 1 1 Nobuo Ochiai , Kikuo Sasamoto , Frank 2 2 David , Pat Sandra 1 Gerstel K.K., 1-3-1 Nakane, Meguro-ku, 152-0031 Tokyo, Japan 2 Research Institute for Chromatography, Kennedypark 26, 8500 Kortrijk, Belgium 15.40 – 17:00 Coffee Break – Seminars – Exhibition – Posters E, F, G, H, N, Q 15:45 – 16:45 Room 1000 Seminar PerkinElmer See page 45 for details Room 300 Seminar GERSTEL See page 45 for details Room 100 Seminar VUV Analytics See page 45 for details 17:00 – 18.30 ISCC KEYNOTE LECTURES: Young Scientists 1 – Room 1000 Chairperson: Peter J. Schoenmakers Analytical Chemistry (HIMS) - University of Amsterdam, Amsterdam, Netherlands ISCC KEYNOTE LECTURES: Young Scientists 2 – Room 300 Chairperson: Gert Desmet Department of Chemical Engineering - Vrije Universiteit Brussel, Brussels, Belgium 31 17:00 KNL.01 CHARACTERIZATION OF AN IMMOBILIZED ENZYME REACTOR (IMER) FOR ON-LINE PROTEIN DIGESTION Stephanie Moore, Stephanie M. Hess, James W. Jorgenson Department of Chemistry - UNC-Chapel HIll, 125 South Road, 27599 Chapel Hill, United States KNL.08 DEVELOPMENT AND APPLICATIONS OF A MICROCHIP CE-nESI-HPMS PLATFORM 1 2 William M. Gilliland , John S. Mellors , John 1 M. Ramsey 1 University of North Carolina, 251 Chapman Hall, CB#3216, NC 27599 Chapel Hill, United States 2 908 Devices, Inc., 27 Drydock Ave, 02210 Boston, United States 17:15 KNL.02 INVESTIGATION OF LIVER AND PLASMA VOLATOLOME BY SOLIDPHASE MICROEXTRACTION COUPLED WITH GAS CHROMATOGRAPHY-MASS SPECTROMETRY TO REVEAL DIETARY EXPOSURE TO POLLUTANTS 1 2 Jihene Bouhlel , Jeremy Ratel , Said 2 3 Abouelkaram , Elisabeth Baeza , Catherine 4 1 Jondreville , Douglas Rutledge , Erwan 2 Engel 1 Analytical Engineering and Food Quality Agroparistech, 16 Rue Claude Bernard, 75005 PARIS, France 2 UR 370 QuaPA - INRA, Mass Group, 63122 Saint-Genes-Champanelle, France 3 URA83 - INRA, MOCA Group, 37380 Nouzilly, France 4 USC 340 - University Lorraine, URAFPA, 54500 Vandoeuvre-Lès-Nancy, France KNL.09 EXPLORING THE POTENTIAL OF A NEW ANALYTICAL APPROACH, NTME/GC-MS, TO ESTABLISH THE VOLATOMIC PATTERN OF URINE SAMPLES 1 1 Priscilla Porto-Figueira , Jorge A. Pereira , 1,2 José S. Câmara 1 Analytical Chemistry and Enology Lab Centro de Química da Madeira, Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 17:27 KNL.03 EVALUATION OF DYNAMIC MULTIDIMENSIONAL GAS CHROMATOGRAPHY WITH ACCURATE MASS TIME-OF-FLIGHT MASS SPECTROMETRY FOR THE STUDY OF MOLECULAR TRANSFORMATION Yong Foo Wong, Chadin Kulsing, SungTong Chin, Philip Marriott School of Chemistry, Monash University, Wellington Rd, Clayton 3800, Victoria, 3800 Clayton, Victoria, Australia KNL.10 STUDY OF LARGE MOLECULES USING ON-LINE LIQUID CHROMATOGRAPHY × GAS CHROMATOGRAPHY-MASS SPECTROMETRY 1 2 Marta P. Mourao , Joen Hermans , Pieter 2 1 1,3 Iedema , Arend Kolk , Hans-Gerd Janssen 1 Analytical Chemistry Group - University of Amsterdam, P.O. Box 94157, 1090 GD Amsterdam, Netherlands 2 Computational Polymer Chemistry Group University of Amsterdam, P.O. Box 94157, 1090 GD Amsterdam, Netherlands 3 Advanced Measurement and Data Modelling - Unilever R&D, P.O. Box 114, 3130 AC Vlaardingen, Netherlands 17:39 KNL.04 UNDERSTANDING THE EFFECT OF THE PDMS-LAYER ON THE KINETICS AND THERMODYNAMICS OF ANALYTES SORPTION ONTO THE MATRIXCOMPATIBLE COATING 1 Erica A. Souza-Silva , Emanuela 2 2 Gionfriddo , Janusz Pawliszyn 1 Instituto de Quimica - Universidade Federal do Rio Grande do Sul, Avenida Venancio Aires, 306 - ap 204, 90040-190 Porto Alegre, Brazil 2 University of Waterloo, 200 University Ave W, N2L 3G1 Waterloo, Canada KNL.11 VAN DE GRAAFF GENERATOR FOR CAPILLARY ELECTROPHORESIS 1 1 Seung Jae Lee , Eric R. Castro , Rosanne M. 2 3 1 Guijt , Mark D. Tarn , Andreas Manz 1 Microfluidics group - KIST-Europe, Campus E7 1, 66123 Saarbrucken, Germany 2 School of Medicine and ACROSS, Private Bag 26, HobartTAS 7001 Tasmania, Australia 3 Department of Chemistry, Cottingham Road, HU67RX Hull, United Kingdom 32 17:51 KNL.05 HYDROCHARS AS NEW COATING MATERIAL FOR BAR ADSORPTIVE MICROEXTRACTION FOR THE DETERMINATION OF PHARMACEUTICALS AND PERSONAL CARE PRODUCTS IN AQUEOUS MATRICES Samir M. Ahmad, Ana S. Mestre, Nuno R. Neng, Ana P. Carvalho, José M. F. Nogueira Center of Chemistry and Biochemistry Faculty of Sciences, University of Lisbon, Faculdade de Ciências da Universidade de Lisboa, Campo Grande, 1749-016 Lisbon, Portugal KNL.12 DO FLUORINATED SURFACTANTS STICK AROUND? LONGITUDINAL TRENDS OF PFAS SERUM LEVELS FROM THE PROSPECTIVE INVESTIGATION OF THE VASCULATURE IN UPPSALA SENIORS (PIVUS) 1 1,2 Jordan A. Stubleski , Samira Salihovic , Lars 3 4 1 Lind , Monica Lind , Anna Kärrman , Bert Van 1,5 Bavel 1 Environmental Chemistry - Örebro University, Fakultetsgatan 1, 702 81 Örebro, Sweden 2 Medical Sciences, Molecular Epidemiology Uppsala University, BMC, Navet, 751 41 Uppsala, Sweden 3 Medical Sciences, Cardiovascular Epidemiology; EpiHealth - Uppsala University, Dag Hammarskölds väg 10B, 75237 Uppsala, Sweden 4 Medical Sciences, Occupational and Environmental Medicine - Uppsala University, Ulleråkersv. 40, 751 85 Uppsala, Sweden 5 Environmental Chemistry - Norwegian Institute for Water Research, Gaustadalléen 21, 0349 Oslo, Norway 18:03 KNL.06 DEVELOPING (CAPILLARY) LC×LC METHODS RAPIDLY AND EFFECTIVELY WITH OPTIMIZED SHIFTING GRADIENTS IN THE SECOND DIMENSION 1,2 1 Bob W. Pirok , Gabriel Vivó-Truyols , 1 Peter J. Schoenmakers 1 Analytical Chemistry (HIMS) - University of Amsterdam, Science Park 904, 1098 XH Amsterdam, Netherlands 2 TI-COAST, Science Park 904, 1098 XH Amsterdam, Netherlands KNL.13 A HIGHLY SENSITIVE GC-DETECTOR BASED ON DIELECTRIC BARRIER DISCHARGE IONIZATION Ansgar T. Kirk, Torben Last, Stefan Zimmermann Institute of Electrical Engineering and Measurement Technology, Department of Sensors and Measurement Technology Leibniz University Hannover, Appelstr. 9A, 30167 Hannover, Germany 18:15 KNL.07 ANALYSIS OF COMPLEX HYDROCARBON MIXTURES AS FOOD + CONTAMINANTS BY ON-LINE LC(AG )LC-GC 1 2 Martin Lommatzsch , Maurus Biedermann , 1 2 Thomas J. Simat , Konrad Grob 1 Chair of Food Science and Food Contact Materials - TU Dresden, Bergstr. 66, 01062 Dresden, Germany 2 KLZH, Fehrenstr. 15, 8032 Zurich, Switzerland KNL.14 CONDENSATION VERSUS CHAINGROWTH POLYMERIZED IONIC LIQUIDS AS HIGH TEMPERATURE STABLE STATIONARY PHASE IN GAS CHROMATOGRAPHY 1 2 Kevin Roeleveld , Frank David , Frédéric 1 Lynen 1 Separation Science Group - Ghent University, Krijgslaan 281, 9000 Gent, Belgium 2 Research Institute for Chromatography, President Kennedypark 26, 8500 Kortrijk, Belgium 18:45 Wine and Cheese offered by AGILENT TECHNOLOGIES, Terrace Hotel Sole 33 Thursday June 2, 2016 08:30 – 10:30 ISCC Session 8 – OTHER COMPREHENSIVE TECHNIQUES - Room 1000 Chairperson: Mark Schure Kroungold Analytical Inc., Blue Bell, United States ISCC Session 9 - ELECTRODRIVEN TECHNIQUES - Room 300 Chairperson: Salvatore Fanali Italian National Research Council-C.N.R., Monterotondo Scalo (Roma), Italy 08:30 LE.39 IN PURSUIT OF THE MICROBOSPHERE 1 Francesco Cacciola , Domenica 2 3 Mangraviti , Francesca Rigano , Paola 1 2,3 2,3 Donato , Paola Dugo , Luigi Mondello , 4 Yukari Nishizawa-Brennen , Karen M. 4 4 5 Draths , John W. Frost , Hernan J. Cortes 1 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Viale Consolare Valeria, 98165 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali University of Messina, Viale Annunziata, Polo Annunziata, 98168 Messina, Italy 3 Chromaleont s.r.l, c/o University of Messina, Viale Annunziata, Polo Annunziata, 98168 Messina, Italy 4 Department of Chemistry - Michigan State University, 578 S. Shaw Lane, 48824 East Lansing, United States 5 Hernan Cortes Consulting LLC, 4613 Springbrook Court, 48642 Midland, United States LE.45 CAPILLARY ZONE ELECTROPHORESISTANDEM MASS SPECTROMETRY FOR PHOSPHOPROTEOMIC ANALYSIS Norman Dovichi University of Notre Dame, 251 Nieuwland Science Hall, 46556-5670 Notre Dame, IL, United States 08:50 LE.40 RECENT APPLICATIONS OF LC×LC TO NATURAL PRODUCTS ANALYSIS 1,2 3 Paola Dugo , Francesco Cacciola , Paola 3 1,2 Donato , Luigi Mondello 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali University of Messina, Polo Annunziata, Viale Annunziata s.n., 98168 Messina, Italy 2 Chromaleont s.r.l, c/o University of Messina, Viale Annunziata, Polo Annunziata, 98168 Messina, Italy 3 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Viale Consolare Valeria, 98165 Messina, Italy LE.46 NANOSPRAY INTERFACING FOR CAPILLARY ELECTROPHORESIS-MASS SPECTROMETRY Frantisek Foret, Jana Krenkova, Anna Tycova, Karel Kleparnik Institute of Analytical Chemistry, ASCR, v.v.i., 60200 Brno, Czech Republic 09:10 LE.45 LE.41 DEVELOPING AND IMPROVING LC×LC SEPARATIONS Peter Schoenmakers, Anna Baglai, Henrik Cornelisson van de Ven, Andrea Gargano, Bob Pirok, Bert Wouters. University of Armsterdam, Nieuwe Achetergracht 166, 1018 WV Amsterdam, The Netherlands LE.47 MICROFABRICATED CE-NESI DEVICES FOR THE ANALYSIS OF BIOPHARMACEUTICAL MATERIALS 1 2 Erin A. Redman , J. Scott Mellors , J.Michael 1 Ramsey 1 University of North Carolina, 251 Chapman Hall, CB#3216, NC 27599 Chapel Hill, United States 2 908 Devices Inc., 27 Drydock Ave., 02210 Boston, United States 34 09:30 LE.42 QUANTITATION IN MULTIPLE-HEARTCUTTING TWO-DIMENSIONAL LIQUID CHROMATOGRAPHY WITH UV AND ESIMS DETECTION 1 2 Monika Dittmann , Stephan Buckenmaier , 3 Matthias Pursch 1 Agilent Technologies, Hewlett-Packard Str. 8, 76337 Waldbronn, Germany 2 R&D - Agilent Technologies, HewlettPackard Str. 8, 76337 Waldbronn, Germany 3 Analytical Technology Center - Dow Deutschland Anlagengesellschaft mbH, Industriestrasse 1, 77836 Rheinmuenster, Germany LE.48 SOLID-PHASE EXTRACTION, FLUORESCENCE LABELING AND ELECTROPHORETIC SEPARATION OF PRE-TERM BIRTH BIOMARKERS USING AN INTEGRATED MICROFLUIDIC DEVICE Adam T. Woolley, Vishal Sahore, Suresh Kumar, Anna V. Nielsen, Mukul Sonker, Ellen K. Parker, Jacob B. Nielsen Department of Chemistry/Biochemistry Brigham Young University, C100 BNSN, 84602 Provo, UT, United States 09:50 LE.43 COMPREHENSIVE TWO-DIMENSIONAL LIQUID CHROMATOGRAPHY USING RPUHPLC AS THE SECOND SEPARATION DIMENSION FOR CAROTENOID ANALYSIS 1 2 Paola Donato ,Veronica Inferrrera , 1 1 Daniele Giuffrida , Francesco Cacciola , 3 2,4 Kevin Schug , Paola Dugo , Luigi 2,4 Mondello 1 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Viale Consolare Valeria, 98165 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali University of Messina, Polo Annunziata, Viale Annunziata s.n., 98168 Messina, Italy 3 Chemistry and Biochemistry - University of Texas at Arlington, 700 Planetarium PI., Box 19065, TX 76019-0065 Arlington, United States 4 Chromaleont s.r.l, c/o University of Messina, Viale Annunziata, Polo Annunziata, 98168 Messina, Italy LE.49 TEMPERATURE MODULATION IN PACKED AND OPEN TUBULAR CAPILLARY ELECTROCHROMATOGRAPHY Frederic Lynen Separation Science Group - Department of Organic and Macromolecular Chemistry Ghent University, Krijgslaan 281 S4-bis, 9000 Ghent, Belgium 10:10 LE.44 COMPREHENSIVE TWO-DIMENSIONAL LIQUID CHROMATOGRAPHY COUPLED TO MASS SPECTROMETRY (LC×LCMS/MS) FOR GEOGRAPHICAL ORIGIN ASSIGNMENT OF LICORICE 1 1 Lidia Montero , Elena Ibanez , Mariateresa 2 2 3 Russo , Rosa di Sanzo , Luca Rastrelli , 1 1 Alejandro Cifuentes , Miguel Herrero 1 Institute of Food Science Research-CIAL (CSIC), Spain, Nicolas Cabrera 9, 28049 Madrid, Spain 2 Dipartimento di Agraria (QuaSic.A.Tec.), Università Mediterranea di Reggio Calabria, loc. Feo di Vito, 89122 Reggio Calabria, Italy 3 Dipartimento di Farmacia, Università di Salerno, Via Giovanni Paolo II 132, 84084 Fisciano, Italy LE.50 CAPILLARY ELECTROPHORESIS FOR DESCRIPTION OF NANOPARTICLES IONIC CORONA Jan Petr, Daniel Baron, Jana Horska, Andrea Sebestova Department of Analytical Chemistry - Palacky University in Olomouc, Regional Centre of Advanced Technologies and Materials, 17. listopadu 12, 77146 Olomouc, Czech Republic 35 10:30 – 12:00 Coffee Break – Seminars – Exhibition – Posters J, P 10:45 – 11:45 Room 1000 Seminar THERMO FISHER SCIENTIFIC See page 46 for details Room 300 Seminar BRECHBUELER See page 46 for details Room 100 Seminar JEOL EUROPE See page 46 for details 12:00 – 14:00 Lunch Break (on your own) 14:00 – 15:40 ISCC Session 10 - STATE OF THE ART GC APPLICATIONS - Room 1000 Chairperson: Milton L. Lee Brigham Young University, Provo, UT, United States ISCC Session 11 - MONOLITHS AND COLUMN TECHNOLOGY - Room 300 Chairperson: Marja-Liisa Riekkola University of Helsinki, Helsinki, Finland 14:00 LE.51 DIRECT MEASUREMENT OF ELEMENTAL MERCURY BY GAS CHROMATOGRAPHY AND ULTRAVIOLET PHOTOMETRIC DETECTION 1,2 3,2 Robert A. Shellie , Ronda Gras , Jim 3,4 Luong 1 Trajan Scientific and Medical, 7 Argent Place, 3134 Ringwood, Australia 2 ASTech - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 3 Analytical Technology Centre - Dow Chemical Canada, Highway 15, T8L2P4 Fort Saskatchewan, Canada 4 ACROSS - University of Tasmania, Private Bag 75, 7001 Hobart, Australia LE.56 PRACTICE AND RAMIFICIATIONS OF ULTRAFAST LC AND SFC Daniel W. Armstrong Department of Chemistry and Biochemistry University of Texas at Arlington, Arlington, TX76019 Arlington, United States 14:20 LE.52 GC-IMS-QTOF-MS – A NEW HYPHENATED SEPARATION TECHNIQUE FOR THE ANALYSIS OF COMPLEX SAMPLES Oliver J. Schmitz University of Duisburg-Essen, Universitaetsstr. 5, 45141 Essen, Germany LE.57 UNDERSTANDING PORE STRUCTURE IN CHROMATOGRAPHIC PARTICLES USING FOCUSED ION BEAM/SCANNING ELECTRON MICROSCOPY (FIB/SEM) AND ADVANCED COMPUTER MODELING 1 2 Mark Schure , Taylor Shields , Brian M. 2 3 4 Wagner , Clare M. Wunder , Robert S. Maier , 2 Joseph J. Kirkland 1 Kroungold Analytical Inc, 1299 Butler Pike, PA 19422 Blue Bell United States 2 Advanced Materials Technology, Inc., 3521 Silverside Road, 19810 Wilmington, United States 3 Dept of Chemical Engineering - University of Delaware, 150 Academy Street, 19716 Newark, United States 4 Robert S Maier Consulting, Tucson, United States 36 14:40 LE.53 PHOTOIONISATION-TOF MASS SPECTROMETRY AS DETECTOR FOR THERMOGRAVIMETRY COUPLED TO FAST OPTICALLY HEATED GAS CHROMATOGRAPHY OR GCXGC: INVESTIGATION OF FLAVOR FORMATION IN ROASTING OF FOODSTUFFS AND ANALYSIS OF PETROCHEMICAL FRACTIONS 1,2 1 Ralf Zimmermann , Thomas Gröger , 1 1 Michael Fischer , Thorsten Streibel , 3 Andreas Walte , Mohammad Saraji3 4 Bozorgzad , Thomas Denner , Sebastian 1 Wohlfahrt 1 Joint Mass Spectrometry Centre/Cooperation Group Comprehensive Molecular Analytics - Helmholtz Zentrum München, Ingolstädter Landstrasse 1, 85764 Neuherberg, Germany 2 Institute of Chemistry - University of Rostock, Dr.-Lorenz-Weg 1, 18051 Rostock, Germany 3 Photonion Gmbh, Hagenowerstr 71, 19061 schwerin, Germany 4 Netzsch GmbH, Wittelsbacherstraße 42,, 95100 Selb, Germany LE.58 METAL-ORGANIC FRAMEWORKS: NEW MEANS TO PREPARATION OF CHROMATOGRAPHIC MEDIA WITH CONTROLLED SELECTIVITY Frantisek Svec Lawrence Berkeley Nat. Lab., Mail Stop 67R6110, CA 94720 Berkeley, United States 15:00 LE.54 SCREENING OF FLAME RETARDANTS AND OTHER ADDITIVES IN ELECTRONIC WASTE, PLASTICS AND OTHER MATERIALS WITH DIRECT PROBE COUPLED TO ATMOSPHERIC PRESSURE CHEMICAL IONIZATIONHIGH RESOLUTION TIME-OF-FLIGHT MASS SPECTROMETRY Ana Ballesteros-Gomez, Jacob De Boer IVM - VU University, De Boelelaan 1087, 1081HV Amsterdam, Netherlands LE.59 HOW IMPORTANT IS STRUCTURAL SIMILARITY IN QUANTITATIVE STRUCTURE-RETENTION RELATIONSHIPS 1 1 1 Paul Haddad , Soo H. Park , Maryam Taraji , 1 1 1 Yabin Wen , Mohammad Talebi , Ruth Amos , 1 2 Robert Shellie , Roman Szucs , John W. 3 4 Dolan , Christopher A. Pohl 1 School of Chemistry - ACROSS, University of Tasmania, Private Bag 75, 7001 Hobart, Tasmania, Australia 2 Pfizer Global R&D, Sandwich, CT139NJ Sandwich, United Kingdom 3 LC Resources, 1795 NM Wallace Rd, 97128 McMinnville, United States 4 ThermoFisher Scientific, Sunnyvale, 94085 Sunnyvale, United States 15:20 LE.55 IMPLEMENTATION OF AN ADVANCED WORKFLOW TO ENHANCE THE CONFIDENCE IN COMPOUND IDENTIFICATION FOR NON-TARGETED GC-HR-MS APPLICATIONS Eric Dossin, Elyette Martin, Antonio Castellon, Pierrick Diana, Pavel Pospisil, Mark Bentley, Philippe Guy Philip Morris International R&D - Philip Morris Products S.A., Quai Jeanrenaud 5, 2000 Neuchatel, Switzerland LE.60 POLYMERIC MONOLITHIC MATERIALS FOR RAPID SAMPLE PREPARATION 1 2 3 Emily Hilder , Esme Candish , Robert Shellie , 1 3 Sara Thomas , Hans-Juergen Wirth , Andrew 3 3 Gooley , Wei Boon Hon 1 University of South Australia, GPO Box 2471, 5001 Adelaide, Australia 2 University of Tasmania, ACROSS, 7001 Hobart, Australia 3 Trajan Scientific and Medical, 7 Argent Place, 3134 Ringwood, Australia 15:40 – 17:00 Coffee Break – Seminars – Exhibition – Posters M, O 15:45 – 16:45 Room 1000 Seminar MERCK/SIGMA/ALDRICH/SUPELCO See page 46 for details Room 300 Seminar RESTEK See page 47 for details Room 100 Seminar CHROMALEONT See page 47 for details 37 17:00 – 18.30 ISCC KEYNOTE LECTURES: SAMPLE PREPARATION 2 AND GC- Room 1000 Chairperson: Elena Ibanez Instituto de Investigación en Ciencias de la Alimentación-CIAL (CSIC), Madrid, Spain ISCC KEYNOTE LECTURES: MULTIDIMENSIONAL TECHNIQUES AND MISCELLANEA - Room 300 Chairperson: Ralf Zimmermann Comprehensive Molecular Analytics, Munich, Germany 17:00 KNL.15 DETERMINATION OF ACRYLAMIDE IN ROASTED COFFEE POWDERS AND BREWS AT TRACE LEVEL BY SOLID PHASE MICROEXTRACTION WITH POLYMERIC IONIC LIQUID-BASED FIBERS AND GC-MS 1 1 Cecilia Cagliero , Chiara Cordero , Erica 1 1 Liberto , Barbara Sgorbini , Patrizia 1 2 1 Rubiolo , Jared L. Anderson , Carlo Bicchi 1 Dipartimento di Scienza e Tecnologia del Farmaco - Università di Torino, Via Pietro Giuria, 9, 10125 Torino, Italy 2 Department of Chemistry - Iowa State University, 1605 Gilman Hall, 50011 Ames, United States KNL.21 EVALUATION AND FUNCTION OF DAMINOACID IN BRAIN TISSUE BY TWO DIMENSIONAL LIQUID CHROMATOGRAPHY 1 1 1 Choyce Weatherly , Siqi Du , Curran Parpia , 2 2 Polan Santos , Adam Hartman , Daniel 1 Armstrong 1 The University of Texas at Arlington, 76019 Arlington, United States 2 Johns Hopkins Hospital, 1800 Orleans St, 21287 Baltimore, United States 17:15 KNL.16 NEW MATERIALS FOR MAGNETIC SOLID PHASE EXTRACTION AND ENRICHMENT OF PHOSPHORYLATED PEPTIDES Susy Piovesana, Anna Laura Capriotti, Francesca Ferraris, Aldo Laganà Dipartimento di Chimica - Sapienza Università di Roma, Piazzale Aldo Moro 5, 185 Rome, Italy KNL.22 FROM X-MS TO X×MS. HOW TO TRANSFORM A HYPHENATED TECHNIQUE TO A TWO DIMENSIONAL SEPARATION USING SIMPLE CHEMOMETRICS TOOLS Guillaume L. Erny, Arminda Alves Laboratory for Process Engineering, Environment, Biotechnology and Energy Faculdade de Engenharia da Universidade do Porto, Rua do Dr. Roberto Frias, s/n, 4200 465 Porto, Portugal 17:30 KNL.17 ANALYZE OF PESTICIDES IN FOOD PRODUCT USING SFE-SFC-MSMS 1 2 Sigrid Baumgarten , Manasi Panov 1 Shimadzu Europa, Albert-Hahn-Straße 610, D-47269 Duisburg, Germany 2 Chem Analytical Services Ltd, 65A Cherni Vrah blvd, 1407 Sofia, Bulgaria KNL.23 HIGH EFFICIENCY MULTIDIMENSIONAL GAS CHROMATOGRAPHY COUPLED TO ISOTOPE RATIO MASS SPECTROMETRY AND QUADRUPOLE MASS SPECTROMETRY SIMULTANEOUS DETECTION 1 1 Danilo Sciarrone , Antonino Schepis , Luigi 1,2 Mondello 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali Università degli Studi di Messina, Viale Annunziata, 98168 Messina, Italy 2 Chromaleont S..r.l. – Viale Boccetta 70, 98122 Messina, Italy 17:45 KNL.18 EXPLOITING THE VERSATILITY OF VACUUM-ASSISTED HEADSPACE SOLIDPHASE MICROEXTRACTION 1 1 Evangelia Yiantzi , Maria-Lito Glykioti , 2 2 Maria Celeiro , Maria Llompart , Elefteria 1 Psillakis 1 Department of Environmental Engineering - Technical University of Crete, Polytechneioupolis, GR-73100 Chania Crete, Greece 2 Department of Analytical Chemistry University of Santiago de Compostela, University Campus, E-15782 Santiago de Compostela, Spain KNL.24 MULTIDIMENSIONAL GAS CHROMATOGRAPHY HYPHENATED TO ISOTOPIC RATIO MASS SPECTROMETRY FOR CARBON DELTA VALUE MEASUREMENTS AND QUADRUPOLE MS FOR MOLECULAR CONFIRMATION IN THE INVESTIGATION OF ENDOGENOUS ANABOLIC STEROIDS IN URINE 1 2 Alessandro Casilli , Thomas Piper , Fabio A. 1 1 Oliveira , Monica Padilha , Henrique M. 1 2 Pereira , Mario Thevis , Francisco R. Aquino 1 Neto 1 LBCD-LADETEC - Universidade Federal do Rio de Janeiro, Instituto de Química, 1281, 22941-909 Rio de Janeiro, Brazil 2 Center for Preventive Doping ResearchInstitute of Biochemistry - German Sport University Cologne, Am Sportpark Müngersdorf 6, 50933 Köln, Germany 38 18:00 KNL.19 IDENTIFICATION WITH HEADSPACE SOLID PHASE MICROEXTRACTION (SPME) AND GAS CHROMATOGRAPHYMASS SPECTROMETRY (GC-MS) OF VOLATILE ORGANIC COMPOUNDS PRODUCED IN-VITRO BY BACTERIA ISOLATED FROM HUMAN FACE SKIN MICROBIOTA 1 2 Chiara Carazzone , Marcela Tabares , 2 3 Martha Vives , Mario I. Ortiz , Jorge 3 Molina 1 Department of Chemistry - Universidad de los Andes, Carrera 1# 18A-10, 111711 Bogota, Colombia 2 Centro de Investigaciones Microbiologicas - Universidad de los Andes, Carrera 1# 18A-10, 111711 Bogota, Colombia 3 Centro de Investigaciones en Microbiologia y Parasitologia Tropical Universidad de los Andes, Carrera 1# 18A10, 111711 Bogota, Colombia KNL.25 CHARACTERIZATION AND QUANTIFICATION OF ULTRA-THIN POLYMER FILMS BY HYPHENATED MASS SPECTROMETRIC TECHNIQUES 1 1 Valentina Gianotti , Diego Antonioli , Katia 1 1 Sparnacci , Michele Laus , Tommaso J. 2 2 Giammaria , Monica Ceresoli , Gabriele 2 2 Seguini , Michele Perego 1 DISAV Dipartimento di Scienze dell'Ambiente e della Vita - University of Piemonte Orientale, Viale T. Michel 11, 15121 Alessandria, Italy 2 Laboratory MDM - IMM-CNR, Agrate Brianza, 20864 Agrate Brianza, Italy 18:15 KNL.20 INNOVATIVE SOLID-PHASE MICROEXTRACTION COATINGS FOR THE SUPRAMOLECULAR DETECTION OF BTEX IN AIR Federica Bianchi, Nicolò Riboni, Enrico Dalcanale, Maria Careri Dipartimento di Chimica, Università di Parma, Parco Area delle Scienze 17/A, 43124 Parma KNL.26 PEAK DECONVOLUTION TO CORRECTLY AND COMPLETELY ASSESS THE TRUE BAND BROADENING OF CHROMATOGRAPHIC COLUMNS Yoachim Vanderheyden, Gert Desmet, Ken Broeckhoven Department of Chemical Engineering - Vrije Universiteit Brussel, Pleinlaan 2, 1050 Brussels, Belgium 21:00 – 23:00 Discussion - Comprehensive Techniques, Conference Centre - Room 1000 39 Friday, June 3, 2016 08:30 – 10:30 ISCC Session 12 - CAPILLARY GC 2 Room 1000 Chairperson: Robert Synovec University of Washington, Seattle, WA, United States ISCC Session 13 – MICRO LC 2 - Room 300 08:30 LE.61 MICROFABRICATED AND FIELDPORTABLE GC FOR AIR POLLUTION MEASUREMENTS Alastair Lewis, Rachel E. Dunmore, Stephen J. Andrews, Michelle Wang, Jacqui F. Hamilton, Marvin Shaw, Martyn Ward Department of Chemistry - University of York, Heslington, Y010 5DD York, United Kingdom LE.67 SMALL BUGS - BIG IMPACT. METABOLOMICS INVESTIGATION OF THE MICROBIOME Katja Dettmer Institute of Functional Genomics - University of Regensburg, Am Biopark 9, 93053 Regensburg, Germany 08:50 LE.62 DETERMINATION OF ALLERGY SUBSTANCES IN FRAGRANCE BY CAPILLARY GAS CHROMATOGRAPHY / LASER IONIZATION MASS SPECTROMETRY USING A FEMTROSECOND LASER AS AN IONIZATION SOURCE 1 2 Shinpei Shibuta , Tomoko Imasaka , Totaro 1 Imasaka 1 Department of Applied Chemistry, Graduate School of Engineering - Kyushu University, 744 Motooka, Nishi-ku, 8190395 Fukuoka, Japan 2 Graduate School of Design - Kyushu University, 4-9-1 Shiobaru, Minami-ku, 8158540 Fukuoka, Japan LE.68 NOVEL STRATEGY TO SCREEN AND PROFILE STEVIOL GLYCOSIDES OF NATURAL SWEETENERS IN FOOD USING MICROFLUIDIC UPLC ION MOBILITY MASS SPECTROMETRY 1 1 Eimear McCall , Ramesh Rao , Michael 1 1 McCullagh , David Douce , Severine 2 Goscinny 1 Food and Environmental - Waters, Stamford Avenue, SK9 4AX Wilmslow, United Kingdom 2 Wetenschappelijk Instituut VolksgezondheidInstitut Scientifique de Santé Publique, Rue Juliette Wytsmans, 1050 Brussels, Belgium 09:10 LE.63 DIODE ARRAY DETECTION WITH GAS CHROMATOGRAPHY 1,2 1,3 Ronda Gras , Jim Luong , Robert A. 2,4 Shellie 1 Analytical Technology Centre - Dow Chemical Canada, PO BAG 16, Highway 15, T8L2P4 Fort Saskatchewan, AB, Canada 2 ARC Training Centre for Portable Analytical Separation Technologies (ASTech) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 3 Australian Centre for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 4 Trajan Scientific & Medical, 7 Argent Place, 3134 Ringwood, Australia LE.69 ADVANTAGES OF PACKED MICROFLUIDIC SEPARATION CHANNELS FOR VERY HIGH-PRESSURE LIQUID CHROMATOGRAPHY - MASS SPECTROMETRY ANALYSES Fabrice Gritti, Thomas McDonald, Martin Gilar Instrument/Core Research/Fundamental Waters Corporation, 34 Mapple Street, 01157 Milford, United States 09:30 LE.64 FINALLY A SIGNIFICANT IMPROVED CHROMATOGRAPHIC SEPARATION FOR ARGON AND OXYGEN, USING NEW PLOT COLUMN PHASE AND DEPOSITION TECHNOLOGIES 1 2 Jaap de Zeeuw , Bill Bromps , Ashlee 2 2 Reese , Roy Lautamo 1 New products group - Restek Corp., weerhaan 9, 4336 KT 4336 KT Middelburg, Netherlands 2 Restek corp, 4211 Business Dr, 95682 Shingle springs, United States LE.70 ELECTRON IONIZATION LC-MS WITH SUPERSONIC MOLECULAR BEAMS - THE NEW SYSTEM, ADVANTAGES AND BENEFITS Alexander B. Fialkov, Boaz Seemann, Svetlana Tsizin, Tal Alon, Aviv Amirav Chemistry - Tel Aviv University, Ramat Aviv, 69978 Tel Aviv, Israel Chairperson: Peter Myers Department of Chemistry - University of Liverpool, Liverpool, United Kingdom 40 09:50 LE.65 GET THE BEST PEAK SHAPE PERFORMANCE AND CONSISTENCY WITH ULTRA INERT WAX COLUMN 1 2 Laura Provoost , Yun Zou 1 Agilent Crosslab Group - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands 2 Agilent Crosslab Group - Agilent Technologies, 412 Ying Lun Road, 200131 Shanghai, China LE.71 AUTOMATED LIBRARY-BUILDING OF METABOLITES IN COMPLEX SAMPLES 1 1 Albert Robbat , Nicole Kfoury , Amanda 1 2 2 Kowalsick , Yuriy Gankin , Eugene Baidakov 1 Department of Chemistry - Tufts University, 62 Talbot Ave, 02155 Medford, United States 2 EPAM Systems, 41 Univesity Drive, 18940 Newtown, United States 10:10 LE.66 MICROFABRICATED GAS CHROMATOGRAPHY COLUMNS WITH STATIONARY PHASES BASED ON SOLGEL PROCESS 1 2 Elodie Lussac , Florence Ricoul , Bertrand 2 2 3 Bourlon , Eric Ollier , Regis Barattin , 1 1 Valerie PeulonAgasse , Pascal Cardinael 1 Sciences et Méthodes Séparatives University of Rouen, rue Tesnière, 76821 Mont saint aignan, France 2 CEA, LETI - University of Grenoble Alpes, MINATEC Campus, 38054 Grenoble, France 3 APIX Analytics, Miniparc Polytec Immeuble Tramontane, 60 rue des Berges, 38000 Grenoble, France LE.72 INVESTIGATIONS ON THE METABOLIZATION OF XENOBIOTICS IN PLANTS Christian W. Klampfl, Lisa Emhofer, Markus Himmelsbach, Wolfgang Buchberger Johannes Kepler-University, Austria, Altenbergerstr 69, 4040 Linz, Austria 10:30 – 11:00 Coffee Break - Exhibition 11:00 – 12:40 ISCC Session 14 – MISCELLANEOUS Room 1000 Chairperson: Paola Dugo University of Messina, Messina, Italy ISCC Session 15 – SAMPLE PREPARATION 3 - Room 300 Chairperson: Frank David R.I.C., Kortrijk, Belgium 11:00 LE.73 FOOD INGREDIENTS, FOODOMICS AND CANCER Alejandro Cifuentes Foodomics Lab, CIAL, CSIC, Nicolas Cabrera 9, 28049 Madrid, Spain LE.78 DYNAMIC HEADSPACE SAMPLING IN THE ANALYSIS OF SOLID MATRICES OF VEGETABLE ORIGIN Carlo Bicchi, Cecilia Cagliero, Chiara Cordero, Erica Liberto, Patrizia Rubiolo, Barbara Sgorbini Dipartimento di Scienza e Tecn. del Farmaco University of Torino, Via Pietro Giuria 9, 10125 Torino, Italy 11:20 LE.74 MICRO-PLATE ARRAY COLUMNS FOR GC 1 2 Sander Jespers , Frederic Lynen , Gert 1 Desmet 1 Department of Chemical Engineering Vrije Universiteit Brussel (VUB), Pleinlaan 2, 1050 Brussel, Belgium 2 Separation Science Group, Universiteit Gent (Ugent), Krijgslaan 281, B-9000 Gent, Belgium LE.79 SOLID-PHASE MICROEXTRACTION ARROW SYSTEM – A GREAT POTENTIAL FOR SAMPLING AND SAMPLE PREPARATION 1 1 Marja-Liisa Riekkola , Hangzhen Lan , Tuukka 1 1 Rönkkö , Jevgeni Parshintsev , Kari 1 1 2 Hartonen , Luis Barreira , Markku Kulmala 1 Laboratory of Analytical Chemistry, Department of Chemistry - University of Helsinki, P.O. Box 55, 00014 Helsinki, Finland 2 Division of Atmospheric Sciences, Department of Physics - University of Helsinki, P.O. Box 64, 00014 Helsinki, Finland 41 11:40 LE.75 A FASCINATING CHROMATOGRAPHIC JOURNEY THROUGH THE FLOWER KINGDOM Elena Stashenko Cenivam-Chemistry - Industrial University of Santander, Building 45, Carrera 27 calle 9, 680002 Bucaramanga, Colombia LE.80 POLYMERIC IONIC LIQUIDS AND MAGNETIC IONIC LIQUIDS IN ANALYTICAL CHEMISTRY Jared L. Anderson Department of Chemistry - Iowa State University, 1605 Gilman Hall, 50010 Ames, United States 12:00 LE.76 INTRODUCTION OF MOMENT ANALYSIS THEORY TO KINETIC STUDY OF INTERMOLECULAR INTERACTION BY AFFINITY CAPILLARY ELECTROPHORESIS Kanji Miyabe Rikkyo University, 171-8501 Tokyo, Japan LE.81 ON-LINE COMBINATION OF SAMPLE PREPARATION-LIQUID CHROMATOGRAPHYTANDEM MASS SPECTROMETRY FOR AUTOMATED DETERMINATION OF RESIDUES AND CONTAMINANTS IN FOOD SAMPLES Fernando M. Lancas Institute of Chemistry at Sao Carlos University of Sao Paulo, Postal Code 780, 13560-970 Sao Carlos, Brazil 12:20 LE.77 COMPARISON OF GC-QMS WITH GCQTOFMS FOR THE NON-TARGETED ANALYSIS OF VOLATILE COMPOUNDS FORMED IN MEAT AND MODEL SYSTEMS 1 1 James B. Addison , Lewis Jones , Kathy 2 2 Ridgway , Nathan Hawkins 1 Flavour Chemistry - Waltham Centre for Pet Nutrition, Freeby Lane, LE14 4RT Melton Mowbray, United Kingdom 2 Anatune Ltd, Wellbrook Court, CB3 0NA Cambridge, United Kingdom LE.82 EXTRACTION, CONCENTRATION AND SEPARATION OF dsDNAS USING AN OPEN CAPILLARY WITHOUT AN APPLIED ELECTRIC FIELD 1 2 Sarah Friedrich , Jeffrey M. Burke , Kelvin 2 1 3 Liu , Tza-Huei Wang , Cornelius F. Ivory 1 Mechanical Engineering - Johns Hopkins University, 108 Latrobe Hall, 21218 Baltimore, United States 2 Circulomics, Inc., , 810 Wyman Park Drive, 21211 Baltimore, United States 3 Chemical Engineering - Washington State University, Wegner 111, Pullman WA, 991646515, United States 12:40 – 13:00 Presentation of the Leslie S. Ettre Award sponsored by PERKINELMER, Inc. Presentation of the Best Poster Award sponsored by SHIMADZU Europa GmbH and SPRINGER Closing Address 13:00 Farewell Cocktail, offered by Waters Corporation, Conference Center 42 -VENDOR SEMINARSTuesday, May 31, 2016 Timing Location Vendor seminar by 15:45 – 16:45 Room 1000 SHIMADZU: Smart solutions for complex samples - Dual and capillary liquid chromatography coupled to tandem mass spectrometry for enhanced throughput and sensitivity Presenter: Gerard Hopfgartner, University of Geneva, Switzerland - SFE-SFC-MS -The latest addition to the chromatography toolbox Presenter: Gesa Schad, Shimadzu Europa Gmbh - Comprehensive 2D gas chromatography combined with a triple-quadrupole mass spectrometer and a useful quali/quantitative tool Presenter: Mariosimone Zoccali, Chromaleont S.r.l., Messina, Italy 15:45 – 16:45 Room 300 LECO - LECO technology development – technical update Presenter: Joe Binkley, LECO Corporation, USA - Statistical comparisons of beer types using GC×GC-(HR) TOFMS Presenter: Jean-Francois F. Focant, Department of Chemistry – University of Liege, Belgium - Spices – are they authentic and safe ? Seeking answer by GC TOFMS Presenter: Jana Haislova, Jaromir Hradecky, Department of Food Analysis and Nutrition, University of Chemistry and Technology, Prague, Czech Republic 15:45 – 16:45 Room 100 ZOEX - Developments in thermal and flow modulators in GC×GC: a tailored solution for every analytical challenge Presenter: Daniela Peroni, Zoex Europe, Netherlands 18:45-20:00 Room 100 AGILENT TECHNOLOGIES Users meeting 43 Wednesday, June 01, 2016 Timing Location Vendor seminar by 10:45 – 11:45 Room 1000 AGILENT TECHNOLOGIES Advance Your Laboratory Power with Agilent’s Innovative Analytical Separation and Detection in Analytical Measurement - Differential Flow Modulated GC×GC-qMS - how to make friendly a complex task Presenter: Chiara Cordero, Dipartimento di Scienza e Tecnologia del Farmaco Università degli Studi di Torino, Turin – Italy - The four separation dimensions of 2D-LC-IM-qTOF-MS as an optimal tool for nontarget analysis Presenter: Oliver J. Schmitz, University of Duisburg-Essen. Faculty of Chemistry, Applied Analytical Chemistry, Essen, Germany 10:45 – 11:45 Room 300 DANI - Advances in separation and detection systems for demanding applications: solid phase deposition GC/FTIR and LN2-free modulator for GC×GC TOFMS Presenter: Albino Sironi, DANI Instruments Alessandro Casilli, LBCD-LADETEC, Instituto de Química, Universidade Federal do Rio de Janeiro, Brasil 10:45 – 11:45 Room 100 PEAK SCIENTIFIC - Switching GC carrier gas – How to set up your GC using hydrogen Presenter: Edward Connor, Peak Scientific, UK 11:45 – 12:45 Room 1000 WATERS - Identification and quantitation of (mixed) halogenated dioxins and furans using atmospheric pressure chemical ionisation quadrupole time of flight mass spectrometry Presenter: Karl Jobst, Department of Chemistry and Chemical Biology, McMaster University, Ontario, Canada - New MS Technologies for Screening and Quantification of Contaminants Presenter: Steve Preece, Waters, Senior Manager MS Business, Europe and India 11:45 – 12:45 Room 300 MARKES INTERNATIONAL - Tandem Ionisation for GC-MS and GC×GC-MS Presenters: Laura McGregor, Markes International Nick Bukowski, Markes International - Forensic blood VOC characterisation by TD–GC×GC–TOF MS with variable-energy electron ionisation Presenter: Katelynn Perrault, University of Liege, Belgium 44 11:45 – 12:45 Room 100 ELEMENTAR/ISOPRIME - Advanced chromatographic interfaces for the detection of isotopic ratios in complex matrixes Presenters: Filip Volders, Christian Schmidt - Elementar Analysensysteme GmbH Eugen Federher, Paul Wheeler - Isoprime Ltd 15:45 – 16:45 Room 1000 PERKINELMER - Pushing the Technology and Application Frontiers in Compact High-performance GC-MS Presenters: Milton Lee, Brigham Young University, UT, USA Philip Marriott, Monash University, Australia 15:45 – 16:45 Room 300 GERSTEL -Extractables and Leachables Analysis using Thermal Desorption and SBSE with GC Single Quad and GC Time-of-Flight Mass Spectrometric Detection Presenters: Andreas Hoffmann , T. Albinus - Gerstel GmbH & Co.KG, Mülheim, Germany E.Almasi, Agilent Technologies, Santa Clara, USA Kurt Thaxton, Gerstel, Inc., Linthicum, USA - SBSE in a routine environment, does it really work? A testimonial. Presenters: C. Devos, B. Tienpont, F. David, and P. Sandra, RIC, Pres Kennedypark 26, B-8500 Kortrijk, Belgium S. Vonckx, European Quality Center, Coca-Cola Services, Brussels, Belgium 15:45 – 16:45 Room 100 VUV Analytics - New Tools for Qualitative and Quantitative GC Analysis using VUV Spectroscopy Presenter: Kevin Schug, Department of Chemistry and Biochemistry, University of Texas at Arlington, Texas, USA - More Selectivity for Complex Samples: Comprehensive Two-dimensional Gas Chromatography – VUV Absorption Spectroscopy Presenter: Thomas Groger, Helmholtzentrum München, Oberschleiheim, Germany 45 Thursday, JUNE 02, 2016 Timing Location Vendor seminar by 10.45 – 11.45 Room 1000 THERMO SCIENTIFIC Life in the Lab using Thermo Scientific Chromatography and Mass Spectrometry. - Challenges in Doping Control Analyses: LC-Orbitrap for fast screening of peptides and small molecules GC/C/IRMS measurements of endogenous anabolic steroid in urine Presenter: Alessandro Casilli, LBCD-LADETEC, Instituto de Química, Universidade Federal do Rio de Janeiro, Brasil - A Deeper Look into the Life of a Dioxins and POPs Lab Presenter: Dave Hope, Pacific Rim Laboratories 10:45 – 11:45 Room 300 BRECHBUEHLER - Advances in automation using the PAL RTC Presenters: Philippe Mottay, Brechbuehler, Switzerland Roger Simon, Brechbuehler, Switzerland 10:45 – 11:45 Room 100 JEOL Introduction of the JEOL JMS-T200GC (AccuTofGCx) with the Photoionization source, the ultimate tools for Comprehensive Two-dimensional GC (GC×GC) and High-Resolution TOFMS. Presenters: Professor Jean-Francois Focant and his science group from University of Liege Featuring : - Introduction of the AccuTofGCx and its basic performance - Separation without Fragmentation - Photoionization as a Soft Ionization Source for Comprehensive Two-dimensional GC (GCxGC) and High-Resolution TOFMS - Application with Photoionization as a Soft Ionization Source Presenters: Chip Cody - JEOL USA Junichi Osuga - JEOL Europe Masaaki Ubukata - JEOL Japan Bram van Meer - JEOL Europe 15:45 – 16:45 Room 1000 MERCK/SIGMA-ALDRICH/SUPELCO - New developments in ionic liquid capillary GC column technology Presenter: Len Sidisky - Merck/Sigma-Aldrich/Supelco, Bellefonte, PA, USA - New developments in sample preparation Presenter: Len Sidisky - Merck/Sigma-Aldrich/Supelco, Bellefonte, PA, USA 46 15:45 – 16:45 Room 300 RESTEK - Optimize separation and reduce run times using a new FREE software tool in GC: EZ-GC Method Translator. Learn how to get exact the same peak elution order when changing carrier gas, column dimensions, moving from FID to MS or changing the column flow Presenter: Jaap de Zeeuw, Restek Corporation - Shoot and Dilute GC": Get more analysis and reduced maintenance by smart use of split injection. Presenter: Jack Cochran, Restek Corporation 15:45 – 16:45 Room 100 CHROMALEONT - Powerful supporting tools for a reliable identification of cumbersome samples Presenter: Margita Utczas, Chromaleont S.r.l., Messina, Italy - Flow modulator: a new generation of GC×GC system with a comprehensive software Presenter: Giorgia Purcaro, Chromaleont S.r.l., Messina, Italy - Development of novel hyphenated techniques for characterization of complex samples Presenter: Mariosimone Zoccali, Chromaleont S.r.l., Messina, Italy 47 This page has been left intentionally blank 48 -POSTER LIST- 49 This page has been left intentionally blank 50 _____________________________________________________________________________ A. FUNDAMENTALS _____________________________________________________________________________ A.01 EFFECTS OF DYNAMIC MODIFICATION OF STATIONARY PHASES BY ANALYTES IN GAS CHROMATOGRAPHY. PARTIAL SEPARATION OF ENANTIOMERS Igor G. Zenkevich, Alexander A. Pavlovskii Chemical - State University, Universitetskii prosp., 26, 198504 St. Petersburg, Russia (Russian Fed.) A.02 EVALUATING SEPARATION PROPERITIES OF THERMAL GRADIENT GC H. Dennis Tolley1, Luke T. Tolley2, Samuel E. Tolley2, Abhijit Ghosh2, Milton L. Lee2 Department of Statistics - Brigham Young University, 206 TMCB, 84602 Provo, UT, United States Department of Chemistry, Brigham Young University, 84602 Provo, UT, United States 1 2 A.03 ANALYSIS OF LONGITUDINAL AND RADIAL HOMOGENEITY OF MONOLITHIC SILICA IN CAPILLARIES BY VARIATION OF CAPILLARY INNER DIAMETER Rafael Meinusch1, Kristof Hormann2, Ulrich Tallarek2, Bernd M. Smarsly1 1 Institute of Physical Chemistry - Justus-Liebig-University Giessen, Heinrich-Buff-Ring 17, 35392 Giessen, Germany 2 Department of Chemistry - Philipps-University Marburg, Hans-Meerwein-Strasse, 35032 Marburg, Germany A.04 PAPAIN-FUNCTIONALIZED GOLD NANOPARTICLES AS HETEROGENEOUS BIOCATALYST IN BIOANALYSIS Siyao Liu, Markus Höldrich, Michael Lämmerhofer Pharmaceutical (Bio)Analysis - Institute of Pharmaceutical Sciences, University of Tuebingen, Auf der Morgenstelle 8, 72076 Tübingen, Germany A.05 STUDY OF THE SURFACE DIFFUSION CHARACTERISTICS OF HYPERCARB FOR POLAR ANALYTES Daniel Lunn, Young J. Yun, James W. Jorgenson Department of Chemistry - UNC-Chapel HIll, 125 South Road, 27599 Chapel Hill, United States A.06 ASSURING QUALITY IN THE ANALYTICAL LAB: CERTIFIED REFERENCE MATERIALS FOR GAS CHROMATOGRAPHY Frank Michel1, Christine Hellriegel2, Alexander Rueck2 1 R&D - Sigma-Aldrich/Supelco, Eschenstr. 5, 82024 Taufkirchen, Germany 2 Sigma-Aldrich Chemie GmbH, Industriestrasse 25, 9471 Buchs SG, Switzerland _____________________________________________________________________________ B. COLUMN TECHNOLOGY _____________________________________________________________________________ B.01 CONDENSATION AND CHAIN-GROWTH POLYMERIZED IONIC LIQUIDS AS HIGH TEMPERATURE STABLE STATIONARY PHASE IN GAS CHROMATOGRAPHY Kevin Roeleveld1, Frank David2, Frédéric Lynen1 1 Separation Science Group - Ghent University, Krijgslaan 281, 9000 Gent, Belgium 2 Research Institute for Chromatography, President Kennedypark 26, 8500 Kortrijk, Belgium 51 B.02 NEW DEFINITION FOR MAXIMUM ALLOWABLE OPERATING TEMPERATURE OF WAX GC COLUMNS John Oostdijk, Ngoc-A Dang Agilent Crosslab R&D group - Chemical Applications - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands B.03 IMPROVED INERTNESS IONIC LIQUID CAPILLARY COLUMNS Len Sidisky, Gustavo Serrano, Greg A. Baney, James L. Desorcie, Xin Zheng, Michael D. Buchanan Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States B.04 A SIMPLE AND CONVENIENT WAY TO PACK CAPILLARY LC COLUMNS Hans-Jurgen Wirth1, Robert A. Shellie1,2, Harry Ritchie1, Mike Bailey1 1 Trajan Scientific and Medical, 7 Argent Place, 3134 Ringwood, Australia 2 ASTech - University of Tasmania, Private Bag 75, 7001 Hobart, Australia B.05 CHARACTERISATION OF THREE NEW ETHYLVINYLBENZENE-DIVINYLBENZENE BASED CAPILLARY COLUMNS EXHIBITING ION-EXCHANGE AND HYDROPHOBIC PROPERTIES USING BIOGENIC NEUTRAL AND CHARGED SOLUTES Yan Li1, Pavel N. Nesterenko1, Roger Stanley2, Brett Paull1, Mirek Macka3 School of Physical Sciences and Australian Centre for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 2 Centre for Food Innovation, University of Tasmania, Locked Bag 1370, 7052 Launceston, Australia 3 Chemistry - ACROSS - University of Tasmania (UTAS), Private Bag 75, 7001 Hobart, Australia 1 B.06 UNIQUE SELECTIVITY: THE POWER OF IONIC LIQUID CAPILLARY COLUMNS Len Sidisky, Gustavo Serrano, James L. Desorcie, Greg A. Baney, Daniel L. Shollenberger, Katherine K. Stenerson, Michael D. Buchanan Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States B.07 EVALUATION AND APPLICATIONS OF A HIGHLY INERT POLYETHYLENE GLYCOL BASED CAPILLARY COLUMN TECHNOLOGY Taylor Hayward1, Ronda Gras1, Gary Lee2, Allen Vickers2, Ngoc-A Dang2, Jim Luong1,3 1 Dow Chemical Canada ULC, PO Bag 16, Highway 15, T8L 2P4 Fort Saskatchewan, Canada 2 Agilent Technologies, 91 Blue Ravine Rd, 95630 Folsom, United States 3 Australian Centre for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia _____________________________________________________________________________ C. SAMPLE PREPARATION _____________________________________________________________________________ C.01 PREPARATION OF IMMOBILIZED ENZYME REACTOR USING A HYDROPHILIC, MONOLITHIC BED AS A SUPPORT Kinga Meller, Michal Szumski, Boguslaw Buszewski Department of the Environmental Chemistry and Bioanalytics - Faculty of Chemistry, Nicolaus Copernicus University in Torun, 7 Gagarin St., 87-100 Torun, Poland 52 C.02 APPLICATION OF HOLLOW FIBERS AS EFFECTIVE PHASES FOR FLOATING SAMPLING TECHNOLOGY - THE ROLE ON THE SORPTION-DESORPTION STEPS Alexandra M. Fernandes, Samir M. Ahmad, Nuno R. Neng, José M. Nogueira Centro de Química e Bioquímica - Faculdade de Ciências da Universidade de Lisboa, Campo Grande Edifício C8 piso 2 lab 8.2.48, 1749-016 Lisboa, Portugal C.03 QUANTIFICATION OF PESTICIDES IN FOOD SAMPLES BY MEANS OF MINIATURIZED QuEChERS APPROACH COUPLED TO FAST GC-QqQ MS Antonino Schepis1, Mariosimone Zoccali2, Giorgia Purcaro2, Peter Q. Tranchida1, Luigi Mondello1,2 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - Università degli studi di Messina, Viale Annunziata, 98168 Messina, Italy 2 Chromaleont S.r.L., viale Boccetta, 70, 98122 MESSINA, Italy C.04 NEW GENERATION BAµE DEVICES FOR MICROEXTRACTION ANALYSIS Alessandra H. Ide1,2, Samir M. Ahmad1, Nuno R. Neng1, José M. Nogueira1 1 Centro de Química e Bioquímica - Faculdade de Ciências da Universidade de Lisboa, Campo Grande, Ed C8, 1749-016 Lisboa, Portugal 2 CAPES Foundation - Ministry of Education of Brazil, SBN, Quadra 02, Lote 06, Bloco L, 70040-020 Brasília, Brazil C.05 BAR ADSORPTIVE MICROEXTRACTION (BAµE): AN OUTSTANDING ANALYTICAL TOOL FOR TRACE ANALYSIS Nuno R. Neng1, Alexandra M. Fernandes1, A.M. Segurado1, Alessandra H. Ide1,2, Samir H. Ahmad1, José M. Nogueira1 1 Centro de Química e Bioquímica - Faculdade de Ciências, Universidade de Lisboa, Campo Grande ed. C8 lab.8.2.48, 1749-016 Lisbon, Portugal 2 CAPES Foundation - Ministry of Education of Brazil, SBN, Quadra 02, lote 06, Bloco L, 70040-020 Brasília DF, Brazil C.06 "GREEN" EXTRACTION TECHNIQUE IN THE DETERMINATION OF PESTICIDES IN THE AQUATIC ENVIRONMENT BY GC-MS Agnesa Páleníková, Svetlana Hrouzková, Silvia Zichova Department of Analytical Chemistry - Faculty of Chemical and Food Technology, STU Bratislava, Radlinského 9, 81237 Bratislava, Slovakia C.07 DIRECT IMMERSION SOLID PHASE MICROEXTRACTION OF PESTICIDES FROM SPAGHETTI SAUCE USING A NEW OVERCOATED FIBER Len Sidisky1, Katherine K. Stenerson1, Robert E. Shirey1, Yong Chen1, Tyler Young2 1 Gas R&D - Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States 2 R&D Intern - Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States C.08 AN IMPROVED SAMPLE CLEANUP APPROACH FOR THE GC/MS ANALYSIS OF PAHS IN BUTTER Olga Shimelis1, Katherine Stenerson1, Caitlin Brown2, Jennifer Claus1, Klaus Buckendahl3, Frank Michel3, Anders Fridstrom4, Mike Buchanan1 Sigma-Aldrich/Supelco, 595 N. Harrison Rd., 16823 Bellefonte, United States 2 Pennsylvania State University, ., 16801 State College, United States 3 Sigma-Aldrich Chemie GmbH, Eschenstraße 5, 82024 Taufkirchen, Germany 4 Sigma-Aldrich International GmbH, Wassergasse 7, CH-9000 St. Gallen, Switzerland 1 53 C.09 EVALUATION OF MATRIX-COMPATIBLE SPME COATING AND ITS APPLICATION TO GCBASED FOOD ANALYSIS Erica A. Souza-Silva1, Emanuela Gionfriddo2, Janusz Pawliszyn2 1 Instituto de Quimica - Universidade Federal do Rio Grande do Sul, Avenida Venancio Aires, 306 - ap 204, 90040-190 Porto Alegre, Brazil 2 University of Waterloo, 200 University Ave W, N2L 3G1 Waterloo, Canada C.10 HOW DOES ETHANOL CONTENT DISTURB SPME ADSORPTION OF VOLATILE WINE COMPOUNDS? Erica A. Souza-Silva, Karine P. Nicolli, Janaina A. Barbara, Claudia A. Zini, Elina B. Caramão Instituto de Quimica - Universidade Federal do Rio Grande do Sul, Avenida Venancio Aires, 306 - ap 204, 90040-190 Porto Alegre, Brazil C.11 GC/MS/MS ANALYSIS OF PESTICIDE RESIDUES IN CANNABIS USING QUECHERS EXTRACTION AND CLEANUP WITH AND IMPROVED SORBENT MIXTURE Len Sidisky, Katherine K. Stenerson, Patrick Myers, Olga Shimelis, Michael Ye Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States C.12 BAµE - A NEW APPROACH FOR THE ANALYSIS OF PSYCHOACTIVE CATHINONES IN ORAL FLUID A.M. Segurado, Samir M. Ahmad, C.R. Queirós, Nuno R. Neng, H.M. Gaspar, Josè M. Nogueira Centro de Química e Bioquímica - Faculdade de Ciências, Universidade de Lisboa, Campo Grande ed. C8 lab.8.2.48, 1749-016 Lisbon, Portugal C.13 COMPARISON OF DIFFERENT SPME FIBER COATING MATERIALS AND FIBER GEOMETRIES FOR THE ANALYSIS OF VOLATILE ORGANIC COMPOUNDS IN DRINKING WATER ACCORDING DIN METHOD 38407-41 Peter Egli1, Beat Schilling1, Guenter Boehm2 1 BGB Analytik AG, Webereistrasse 56, 8134 Adliswil, Switzerland 2 CTC Analytics AG, Industriestrasse 20, 4222 Zwingen, Switzerland C.14 FULLY AUTOMATED SAMPLE PREPARATION FOR THE DETERMINATION OF PLASTICIZERS IN PVC FROM FOOD CONTACT MATERIALS AND TOYS Maurus Biedermann1, Reto Bolliger2, Beat Schilling3, Guenter Boehm2 1 Official Food Control Authority - of the Canton of Zurich, Fehrenstrasse 15, 8032 Zurich, Switzerland 2 CTC Analytics AG, Industriestrasse 20, 4222 Zwingen, Switzerland 3 BGB Analytik AG, Webereistr. 56, 8134 Adliswil, Switzerland C.15 REPLACING DISPERSIVE SPE WITH STANDARD SPE FOR QUECHERS BASED AUTOMATED SAMPLE PREPARATION Norbert Helle1, Franziska Chmelka1, Ilka Karrenbrock1, Jochen Vandenberg2, Andreas Hoffmann2,2 1 TeLA GmbH Bremerhaven, Handelspark 4-6, 27624 Geestland, Germany 2 Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany C.16 SAMPLE PREPARATION METHODS BASED ON MICROPOROUS ORGANIC POLYMERS FOR TRACE ANALYSIS OF COMPLICATED SAMPLES Gongke Li, Jialiang Pan, Chengjiang Zhang, Langjun Zhou, Yuling Hu, Zhuomin Zhang School of Chemistry and Chemical Engineering - Sun Yat-sen University, 135 Xingang Xi Road, 510275 Guangzhou, China 54 C.17 DISPERSIVE SOLID PHASE EXTRACTION OF ESTROGENIC COMPOUNDS IN WATER BY POLYDOPAMINE COATED MAGENTIC NANOPARTICLES AND LIQUID CHROMATOGRAPHY-TANDEM MASS SPECTROMETRY Chiara Cavaliere, Giorgia La Barbera, Susy Piovesana, Salvatore Ventura, Riccardo Zenezini Chiozzi, Aldo Laganà Dipartimento di Chimica - Sapienza Università di Roma, Piazzale Aldo Moro 5, 185 Rome, Italy C.18 PERFECT SAMPLE PREPARATION – IS COMPLETE HOLISTIC EXTRACTION OF VOLATILE ORGANIC COMPOUNDS FROM FOODS POSSIBLE? Lewis L. Jones1, Samuel Wordsworth2, Nathan Hawkins3, Kathy Ridgway3 1 Feeding Performance - Flavour Chemistry - Mars Petcare, Waltham Centre for Pet Nutrition, Freeby Lane, LE14 4RT Waltham-on-the-Wolds, United Kingdom 2 The University of Nottingham, University Park, NG7 2RD Nottingham, United Kingdom 3 Anatune, Wellbrook Court, CB3 0NA Cambridge, United Kingdom C.19 INVESTIGATION OF DIFFERENT CATION-EXCHANGE POLYMERS AS A NEW APPROACH FOR THE DETERMINATION OF BASIC DRUGS IN URINE BY SOLID PHASE EXTRACTIONLIQUID CHROMATOGRAPHY-TANDEM MASS SPECTROMETRY Giacomo Musile1, Lucia Cenci2, Elena Piletska3, Rossella Gottardo1, Alessandra M. Bossi2, Federica Bortolotti1 1 Department of Diagnostics and Public Health - University of Verona, p.le L.A. Scuro, 10, 37134 Verona, Italy 2 Department of Biotechnology - University of Verona, strada le Grazie, 37134 Verona, Italy 3 Chemistry Department - Leicester University, University Road, LE1 7RH Leicester, United Kingdom C.20 EFFICIENT MAGNETIC CARBON NANOTUBES METHOD FOR THE DETERMINATION OF COCAINE AND BENZOYLECGONINE IN BREAST MILK BY GAS CHROMATOGRAPHY / MASS SPECTROMETRY Rosimeire R. Santos1, Helvecio C. Menezes1, Ana Paula C. Teixeira1, Maria J. Paiva2, Julio C. Veloso2, Zenilda L. Cardeal1 1 Department of Chemistry - Universidade Federal de Minas Gerais, Av. Antonio Carlos, 6627, 31270901 Belo Horizonte, Brazil 2 Universidade Federal de São João Del Rey, Av. Sebastião Gonçalves Coelho, 400, 35501-296 Divinopolis, Brazil C.21 DEVELOPMENT OF A DYNAMIC HEADSPACE TECHNOLOGY BASED VACUUM EXTRACTION METHOD FOR IMPROVED GAS CHROMATOGRAPHIC ANALYSIS OF FOOD AROMA COMPONENTS IN LIPOPHILIC MATRICES Elvira Paulus1, Birgit Kohlenberg2, Eike Kleine-Benne3, Egon Gross2, Peter Schieberle1, Johannes Kiefl2 1 Lehrstuhl fuer Lebensmittelchemie - Technische Universitaet Muenchen, Lise-Meitner-Straße 34, 85354 Freising, Germany 2 R&T Flavors Division - Symrise AG, Muehlenfeldstrasse 1, 37603 Holzminden, Germany 3 Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, D-45473 Muelheim an der Ruhr, Germany C.22 OPTIMIZATION OF IN-PIPETTE SOLID-PHASE EXTRACTION FOR DETERMINATION OF MINOR COMPONENTS IN VEGETABLE OILS BY GC×GC-FID/MS Giorgia Purcaro1, Flavio A. Franchina1, Laura Barp2, Peter Q. Tranchida2, Luigi Mondello2,1 1 Chromaleont S.r.L., viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, viale Annunziata, 98168 Messina, Italy C.23 GRAPHENE SHEETS SUPPORTED ON AMINOPROPYL SILICA AS SORBENT FOR DETERMINATION OF PARABENS IN WATER SAMPLES BY MICROEXTRACTION BY PACKED SORBENT Bruno H. Fumes, Fernando M. Lanças Institute of Chemistry of São Carlos - University of São Paulo, Av. Trab. São-Carlense, 400, 13566-590 São Carlos, Brazil 55 C.24 GRAPHENE OXIDE SUPPORTED ON AMINOPROPYL SILICA AS SORBENT FOR IN-TUBE SPME DETERMINATION OF TRIAZINES Ana L. Toffoli, Bruno H. Fumes, Fernando M. Lancas Institute of Chemistry of São Carlos - University of São Paulo, Av. Trab. São-Carlense, 400, 13566-590 São Carlos, Brazil C.25 DEVELOPMENT OF A RAPID MINIATURIZED DISPERSIVE LIQUID/LIQUID MICROEXTRACTION METHOD (DLLME) FOR THE DETERMINATION OF THC-COOH IN BIOLOGICAL FLUIDS BY GC-MS Sara Odoardi, Valeria Valentini, Sabina Strano-Rossi Institute of Public Health, Sction of Legal Medicine - Catholic University of Sacred Heart, L.go F. Vito, 1, 00168 Rome, Italy C.26 SUB-PART PER TRILLION HEADSPACE ANALYSIS OF ODOR PRODUCING HALOANISOLES, GEOSMIN, AND 2-METHYLISOBORNEOL IN WATER AND WINE BY GCMS WITHOUT THE NEED TO CONTACT THE LIQUID SAMPLE Daniel B. Cardin, Thomas X. Robinson Analytical Instrumentation - Entech Instruments, Inc., 2207 Agate Ct., 93065 Simi Valley, United States _____________________________________________________________________________ D. SAMPLING SYSTEMS _____________________________________________________________________________ D.01 AUTOMATED CONSECUTIVE GAS SAMPLE TRANSFER SYSTEM FROM POLYMER BAGS AND HIGHLY PRESSURIZED CYLINDERS TO A GAS CHROMATOGRAPH Namgoo Kang Center for Gas Analysis - Korea Research Institute of Standards and Science, 267 Gajeong-ro, Yuseong-gu, 34113 Daejeon, Korea, (South) Republic of D.02 USING TDU-GC-MS TO INVESTIGATE THE VOCS EMISSION OF BRASSICA NAPUS L . PLANTLETS CULTIVATED IN VITRO AND EXPOSED TO CADMIUM ABIOTIC STRESS Bastien Durenne1, Alodie Blondel1, Philippe Druart1, Marie-Laure Fauconnier2 1 Department of Life Sciences, Bioengineering unit - CRA-W, Chaussée de Charleroi 234, 5030 Gembloux, Belgium 2 Chimie Générale Organique - Université de Liège - Gembloux Agro-Bio Tech, 2, Passage des Déportés, 5030 Gembloux, Belgium D.03 EVALUATION OF VARIOUS COATING MATERIALS FOR SPME AND THE NOVEL SPME ARROW FOR THE EXTRACTION OF 1,1,6-TRIMETHYL-1,2-DIHYDRONAPHTHALENE AND VITISPIRANE IN WINE USING MULTIPLE HEADSPACE SOLID PHASE MICROEXTRACTION Michael Ziegler1, Hans-Georg Schmarr1,2 1 Institute for Wine Research - DLR Rheinpfalz, Breitenweg 71, 67435 Neustadt a.d. Weinstraße, Germany 2 Instrumental Analytical Chemistry - University Duisburg-Essen, Universitätsstraße 5, 45141 Essen, Germany D.04 DEVELOPMENT OF NOVEL SAMPLING SYSTEM FOR METABOLOMIC PROFILING OF HUMAN BREATH Mari Päiviö, Hanna-Mari Salmia, Tuulia Hyötyläinen Turku Centre for Biotechnology - University of Turku, Tykistökatu 6 A, 20520 Turku, Finland 56 D.05 XAD-2 AS ALTERNATIVE ADSORBENT FOR THE ANALYSIS OF VOCs BY GC/MS AFTER THERMODESORPTION Andrea C. Marcillo1, Anja Widdig2, Claudia Birkemeyer1 1 Mass Spectrometry Group, Institute of Analytical Chemistry, Faculty of Chemistry and Mineralogy - University of Leipzig, Linnestr. 3, 04103 Leipzig, Germany 2 Institute of Biology, Faculty of Bioscience, Pharmacy and Psychology - University of Leipzig, Talstrasse 3, D-04103 Leipzig, Germany D.06 USE OF AN “INTELLIGENT KNIFE” (IKNIFE), BASED ON THE RAPID EVAPORATIVE IONISATION MASS SPECTROMETRY TECHNOLOGY, FOR AUTHENTICITY ASSESSMENT OF PISTACHIO SAMPLES Francesca Rigano1, Sara Stead2, Renata Jandova2, Davy Petit3, Sara Farnetti4, Nino Marino5, Luigi Mondello6,1 1 Chromaleont SrL, Viale Boccetta 70, 98122 Messina, Italy 2 Waters Corporation, Stamford Avenue, Altrincham Road, SK9 4AX Wilmslow, United Kingdom 3 Waters Corporation, Waters S.A.S., BP 608, 78056 Saint-Quentin En Yvelines Cedex, France 4 Diabetes Research Institute, Division of Cellular Transplantation of Surgery - University of Miami, 1450 NW 10th Avenue, 33136 Miami, United States 5 Pistì – Antichi Sapori dell’Etna S.r.L, Viale J. F. Kennedy / Zona artigianale 12-13, 95034 Bronte (CT), Italy 6 Dipatimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina - Polo Annunziata, Viale Annunziata, 98168 Messina, Italy _____________________________________________________________________________ E. CAPILLARY GAS CHROMATOGRAPHY _____________________________________________________________________________ E.01 ANALYSIS OF CHLORINATED, SULFOCHLORINATED DERIVATIVES OF LAURATE METHYL ESTER BY ELECTRON IONIZATION Amel Asselah1,2, Ammal Tazerouti2 Département du Génie de l'Environnment, Faculté des Sciences de l'Ingénieur-FSI - Université de M'Hamed Bougara-UMBB, Avenue de l'indépendance, 35000 Boumerdes, Algeria 2 Laboratoire de Chimie Organique Appliquée- Faculté de Chimie - Université des Sciences et de la TechnologieUSTHB, BP32, Cité El Alia, 16000 Bab Ezzouar, Algeria 1 E.02 HUMAN BLOOD VS. ANIMAL BLOOD – PROFILING THE SCENT OF TRAINING AIDS FOR BLOOD-DETECTION DOGS Latara Rust, Miroslava Ross, Katie D. Nizio, Shari L. Forbes Centre for Forensic Science - University of Technology Sydney, PO Box 123, 2007 Sydney, Australia E.03 GAS CHROMATOGRAPHIC CHARACTERIZATION OF MONO-ESTERS OF DICARBOXYLIC ACIDS Igor G. Zenkevich, Lilia N. Fakhretdinova Chemical - State University, Universitetskii prosp., 26, 198504 St. Petersburg, Russia (Russian Fed.) E.04 GC FLOW PATH INERTNESS ENSURING RELIABLE RESULTS Laura Provoost1, Yun Zou2 1 Agilent Crosslab Group - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands 2 Agilent Crosslab Group - Agilent Technologies, 412 Ying Lun Road, 200131 Shanghai, China 57 E.05 VUV SPECTRA DATABASE OF FATTY ACIDS DERIVATIZED COUPLED WITH LINEAR RETENTION INDEX APPROACH: RELIABLE IDENTIFICATION TOOL FOR COMPLEX SAMPLES Mariosimone Zoccali1, Margita Utczas1, Giorgia Purcaro1, Luigi Mondello1,2 1 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy E.06 NEW CROSS-LINKED STATIONARY PHASES FOR GC BASED ON POLY(OLIGO ETHYLENGLYCOL DIACRYLATE): KINETIC PERFORMANCE AND THERMODYNAMIC SELECTIVITY Alexander Kurganov, Alexander Korolev, Anastasiya Kanateva, Tamara Popova, Valeriya Shiryaeva Institute of Petrochemical Synthesis - Academy of Sciences, Lenin Avenue 29, 119991 Moscow, Russia (Russian Fed.) E.07 AGILENT J&W DB-WAX ULTRA INERT GC COLUMN, A NEW PEG GC COLUMN WITH IMPROVED INERTNESS RELIABILITY AND COLUMN LIFETIME Ngoc-A T. Dang1, Roy Lensen1, Frans Biermans1, Allen K. Vickers2, Liying Yu2 1 R&D - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands 2 Supply Chain Folsom - Agilent Technologies, Blue Ravine Rd 91, 95630 CA Folsom, United States E.08 THE QUANTITATIVE MEASUREMENT OF WATER BY GC USING IONIC LIQUID CAPILLARY COLUMNS Len Sidisky, Gustavo Serrano, James L. Desorcie, Greg A. Baney, Katherine K. Stenerson, Michael Halpenny, Michael D. Buchanan Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States E.09 ANALYSIS OF BIOMARKERS IN CRUDE OILS FROM COLOMBIA´S EASTERN PLAINS AND MIDDLE MAGDALENA VALLEY BASINS BY GC-QQQ-MS Andrés F. González1,2, Taylor S. Motta1,2, Ivama S. Calles1,2, Jairo R. Martínez1,2, Elena E. Stashenko1,2 1 Department of Chemistry - Universidad Industrial de Santander, Carrera 27 calle 9 UIS, 680002 Bucaramanga, Colombia 2 Centro de Investigación en Biomoléculas-CIBIMOL - Centro de Investigación de Excelencia CENIVAM, Carrera 27 calle 9 UIS Ed-45, 680002 Bucaramanga, Colombia E.10 NEW HIGH TEMPERATURE PEG GC COLUMN WITH ULTRA-LOW BLEED LEVEL Ngoc-A Dang, John Oostdijk, Frans Biermans R&D - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands E.11 THE QUANTIFICATION OF TRACE WATER IN PETROLEUM AND PETROLEUM PRODUCTS Lillian A. Frink, Daniel W. Armstrong Department of Chemistry and Biochemistry - University of Texas at Arlington, Arlington, 76019 Arlington, United States E.12 REDUCE ANALYSIS TIME AND OPTIMIZE SEPARATIONS, WHILE MAINTAINING THE SAME PEAK ELUTION ORDER: A NEW FREE SOFTWARE TOOL IN GC: EZ-GC METHOD TRANSLATOR Jaap de Zeeuw New products group - Restek Corp., weerhaan 9, 4336 KT 4336 KT Middelburg, Netherlands 58 E.13 WHY DON’T MORE PEOPLE USE GUARD COLUMNS IN CAPILLARY GAS CHROMATOGRAPHY? AN INVESTIGATION INTO THE ADVANTAGES AND DISADVANTAGES OF AVAILABLE TECHNIQUES Remko van Loon, Matthew Giardina Gas Phase Separations Division - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands E.14 ANALYSIS OF 1,4-DIOXANE, DIOXANES AND DIOXOLANES IN WATER BY SOLID PHASE EXTRACTION AND GAS CROMATOGRAPHY TANDEM MASS SPECTROMETRY (GC-MS/ MS) Guillem Carrera Ruiz, Lida Vegué Garrich, Rosa Boleda Vall-Llobera Department of Organic Chemistry - Aigües de Barcelona, Empresa Metropolitana de Gestió del Cicle Integral de l'Aigua S.A., General Batet 1-7, 08028 Barcelona, Spain E.15 STUDY OF A NEW CHIRAL BIOACTIVE AND CHOLESTERIC GC COLUMN Ouassila Ferroukhi LABORATOIRE DE CHROMATOGRAPHIE - FACULTE DE CHIMIE USTHB, BP32 ELAALIA, BEZ, ALGER, 16017 ALGER, Algeria E.16 INFLUENCE OF DIFFERENT ARYL GROUPS ON THE SELECTIVITY OF POLYSILOXANES IN GAS CHROMATOGRAPHY Helmut Riering, Natalie Bilmann, Giovanna Cozzupoli, Astrid Wirtz GC - Macherey-Nagel GmbH & Co. KG, Neumann-Neander-Str. 6-8, D-52355 Düren, Germany E.17 NON-MS SIDA QUANTIFICATION OF LOW MOLECULAR WEIGHT SULFUR VOLATILES AFTER HS-SPME-GC-PFPD ANALYSIS Sylvia K. Neef, Sebastian Ullrich, Hans-Georg Schmarr Viticulture and Enology - DLR Rheinpfalz, Breitenweg 71, 67431 Neustadt an der Weinstrasse, Germany E.18 NOVEL MID-POLARITY CYANOPROPYL PHASES WITH SILARYLENE TECHNOLOGY FOR LOWEST BLEED CAPILLARY GC COLUMNS Stefan Hilken, Tanja Harst, Tobias Schäpers, Helmut Riering, Martin Rödel, Andreas Bohne, Dirk Rieger MACHEREY-NAGEL Gmbh & Co. KG, Neumann-Neander-Str. 6-8, 52355 Dueren, Germany E.19 RAPID ANALYSIS OF 32 VOLATILE SULFUR COMPOUNDS (VSCs) IN WINE BY HEADSPACE SOLID PHASE MICROEXTRACTION GAS CHROMATOGRAPHY TANDEM MASS SPECTROMETRY (HS-SPME-GC-MS/MS) Davide Slaghenaufi, Sergio Moser, Loris Tonidandel, Roberto Larcher CTT - Fondazione Edmund Mach, via E. Mach, 1, 38010 San Michele all'Adige, Italy E.20 THE CRITICAL ASSESSMENT OF GC-HRMS BASED METHODS FOR WHISKY AUTHENTICATION Michal Stupak1, Monika Tomaniova1, Ian Goodall2, Jana Hajslova1 1 Food Analysis and Nutrition - UCT, Technicka 3, 166 28 Prague 6, Czech Republic 2 The Scotch Whisky Research Institute, Research Avenue North, EH14 4AP Edinburgh, United Kingdom E.21 CHROMATOGRAPHIC EVALUATION OF THERMODYNAMIC AND KINETIC PROPERTIES OF NEW MEMBRANE POLYMERS WITH INTRINSIC POROSITY AS STATIONARY PHASES IN GC Alexander Kurganov, Anastasiya Kanateva, Alexander Korolev, Elena Yakubenko, Maxim Bermeshev, Pavel Chapala Institute of Petrochemical Synthesis - Academy of Sciences, Lenin Avenue 29, 119991 Moscow, Russia (Russian Fed.) 59 E.22 GAS CHOROMATOGRAPHY-VACUUM ULTRAVIOLET ABSORBANCE SPECTROSCOPY FOR QUANTITATION OF TRACE AND BULK WATER IN ORGANIC SOLVENTS: AN EMERGING ALTERNATIVE TO KARL FISCHER TITRATION Lindsey Shear1, Dale Harrison1, Jonathan Smuts1, Len Sidisky2 1 VUV Analytics, 715 Discovery Blvd., 78613 Cedar Park, United States 2 Supelco, 595 North Harrison Road, 16823 Bellefonte, United States E.23 ISOTOPIC SEPARATION ON A PLOT COLUMN ALLOWS A NON-MS STABLE ISOTOPE DILUTION ASSAY FOR ACETALDEHYDE ANALYSIS USING HS-GC-FID Hans-Georg Schmarr Viticulture and Enology - DLR Rheinpfalz, Breitenweg 71, 67431 Neustadt an der Weinstrasse, Germany E.24 QUANTIFYING OF THE DELTA-9-TETRAHYDROCANNABINOL IN UNCONVENTIONAL MATRIXES Ludmila Komorousova, Michael Roman, Lukas Franek Department of Chemistry - Institute of Criminalistics Prague, P.O.Box 62/KUP, Strojnicka 27, 17089 Prague 7, Czech Republic E.25 FAST PESTICIDE ANALYSIS IN FOOD USING FLOW FIELD THERMAL GRADIENT GAS CHROMATOGRAPHY AND TOF-MS WITH SOFT ELECTRON IONIZATION Jan Leppert1, Kai Schütt1, Gerhard Horner2, Peter Boeker1 1 Institute of Agricultural Engineering - University of Bonn, Nussallee 5, 53115 Bonn, Germany 2 five technologies GmbH, Frauenstraße 22, 80469 München, Germany E.26 VALIDATION OF THE METHOD CAPILARY GAS CHROMATOGRAPHY (GC-FID) FOR THE QUANTITATIVE DETERMINATION OF SYNTHETIC CANNABINOIDS IN FORENSIC PRACTICE Ivo Beroun Depatment of Chemistry - Institute of Criminalistics Prague, Strojnická 27, P.O.Box 62/KÚP, 170 89 Prague, Czech Republic E.27 DECONVOLUTION AND IDENTIFICATION OF COELUTING ISOMERS OF DIMETHYLNAPHTHALENE USING GAS CHROMATOGRAPHY - VACUUM ULTRAVIOLET SPECTROSCOPY Kevin A. Schug1, Jamie Schenk1, Xiaojian Mao1, Jonathan Smuts2, Phillip Walsh2, Peter Kroll1 1 Chemistry and Biochemistry - University of Texas at Arlington, 700 Planetarium PI., Box 19065, TX 76019-0065 Arlington, United States 2 VUV Analytics, Inc., 715 Discovery Blvd Suite 502, 78613 Cedar Park, United States _____________________________________________________________________________ F. (MICRO)LIQUID CHROMATOGRAPHY _____________________________________________________________________________ F.01 DIRECT-EI LC-MS: A NEW CONFIGURATION TO ENHANCE PERFORMANCE AND STABILITY Maurizio Piergiovanni, Giorgio Famiglini, Pierangela Palma, Veronica Termopoli, Achille Cappiello DiSPeA - University of Urbino, Piazza Rinascimento 6, 61029 Urbino, Italy 60 F.02 DETERMINATION OF ANTI-TB DRUGS IN BIOLOGICAL FLUIDS BY LIQUID CHROMATOGRAPHY/TANDEM MASS SPECTROMETRY (LC/MS/MS) FOR OPTIMIZATION TUBERCULOSIS TREATMENT Liudmila A. Kartsova, Elena A. Bessonova, Svetlana A. Soloveva Institute of Chemistry - Saint-Petersburg St. Univ., Universitetskii pr. 26, Peterhof, 198504 Saint-Petersburg, Russia (Russian Fed.) F.03 DEVELOPMENT OF HPLC AND MEKC METHODS FOR THE ANALYSIS OF SULFUR MUSTARD CYCLIC DEGRADATION PRODUCTS Heidi Lees, Mihkel Kaljurand, Merike Vaher Institute of Chemistry - Tallinn University of Technology, Akadeemia tee 15, 12618 Tallinn, Estonia F.04 CHARACTERIZATION OF FREE FATTY ACID PROFILE IN MUSSELS BY NANOLC DIRECTLY COUPLED TO ELECTRON IONIZATION MASS SPECTROMETRY Francesca Rigano1, Ambrogina Albergamo2, Danilo Sciarrone2, Marco Beccaria1, Giorgia Purcaro1, Luigi Mondello2,1 1 Chromaleont SrL, Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina - Polo Annunziata, Viale Annunziata, 98168 Messina, Italy F.05 NANOLC-EI-MS FOR A RELIABLE CHARACTERIZATION OF POLYMETOXYFLAVONES ISOLATED FROM COLD-PRESSED MANDARIN ESSENTIAL OIL BY MEANS OF A MULTIDIMENSIONAL PREPARATIVE HPLC SYSTEM Marina Russo1,2, Francesca Rigano3, Adriana Arigò2, Danilo Sciarrone2, Maria L. Calabrò2, Paola Dugo2,3, Luigi Mondello2,3 1 Unit of Food Science and Nutrition, Department of Medicine - University Campus Bio-Medico of Rome, Via Alvaro del Portillo 21, 00128 Rome, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy 3 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy F.06 LIPIDOMICS-TYPE ANALYSIS BY UHPLC-Q-MS WITH ESI AND APCI INTERFACES Marco Beccaria1, Veronica Inferrera2, Francesca Rigano1, Giorgia Purcaro1, Paola Dugo2,1, Luigi Mondello2,1 1 Chromaleont s.r.l., viale Boccetta, 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy F.07 BUILDING OF A LINEAR RETENTION INDEX SYSTEM IN LIQUID CHROMATOGRAPHY Francesca Rigano1, Danilo Sciarrone2, Luigi Mondello2,1 1 Chromaleont SrL, Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina - Polo Annunziata, Viale Annunziata, 98168 Messina, Italy _____________________________________________________________________________ G. SUPERCRITICAL FLUID CHROMATOGRAPHY AND EXTRACTION _____________________________________________________________________________ G.01 SFC-MS METHOD SCOUTING FOR NOVEL CHIRAL COMPOUNDS Gesa Schad Shimadzu Europa GmbH, Albert-Hahn-Str. 6-11, 47269 Duisburg, Germany 61 G.02 REALISING THE BENEFITS OF CONVERGENCE CHROMATOGRAPHY IN FOOD TESTING Eimear McCall, Ramesh Rao, Jinchuan Yang Food and Environmental - Waters, Stamford Avenue, SK9 4AX Wilmslow, United Kingdom G.03 "IMPACT OF CONVERGENCE CHROMATOGRAPHY COUPLED TO TIME-OF-FLIGHT MASS SPECTROMETRY ON LIPID ANALYSIS: APPLICATIONS TO TRIACYLGLYCEROL FINGERPRINTING IN EDIBLE OILS" Veronica Inferrera1, Paola Donato2, Francesco Cacciola2, Paola Dugo1,3, Luigi Mondello1,3 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy 2 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Viale Consolare Valeria, 98165 Messina, Italy 3 Chromaleont S.r.L., Viale Boccetta, 70, 98122 Messina, Italy 1 G.04 ON-LINE COUPLING OF CO2 SUPERCRITICAL FLUID EXTRACTION AND SUPERCRITICAL FLUID CHROMATOGRAPHY COUPLED TO TRIPLE QUADRUPOLE MASS SPECTROMETRY Mariosimone Zoccali1, Giorgia Purcaro1, Masayuki Nishimura2, Luigi Mondello1,3 1 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 2 Shimadzu Scientific Instruments, Inc., Riverwood Drive, 21046 Columbia, United States 3 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy G.05 SUPERCRITICAL FLUID CHROMATOGRAPHY (SFC) AS ORTHOGONAL TECHNIQUE FOR IMPROVED DETECTION OF POLAR ANALYTES IN ANTI-DOPING CONTROL Marica Barbieri1, Maria K. Parr2, Bernhard Wüst3, Edgar Nägele3, Francesco Botre4 1 Agilent Technologies - , Via Vincenzo Lamaro 13, 00173 Roma, Italy 2 Institut of Pharmacy - Freie Universität Berlin, Kaiserswerther Str. 16-18, 14195 Berlin, Germany 3 Agilent Technologies, Hewlett-Packard-Straße 8, 76337 Waldbronn, Germany 4 Laboratorio Antidoping FMSI, Largo Giulio Onesti, 1, 00197 Rome, Italy _____________________________________________________________________________ H. ELECTROMIGRATION METHODS _____________________________________________________________________________ H.01 DISTRIBUTION CONSTANTS OF LOCAL ANESTHETICS BETWEEN AQUEOUS AND LIPOSOME PHASES Suvi-Katriina Ruokonen1, Filip Dusa1, Paula Holma1, Alexandra Robciuc2, Antti H. Rantamäki1, Juha Holopainen2, Susanne K. Wiedmer1 1 Department of Chemistry - University of Helsinki, A.I. Virtasen aukio 1, 00014 Helsinki, Finland 2 Department of Ophthalmology - University of Helsinki and Helsinki University Hospital, Haartmanninkatu 4, 00290 Helsinki, Finland H.02 NEW APPROACHES FOR ELECTROPHORETIC DETERMINATION OF BIOLOGICALLY ACTIVE COMPOUNDS Elena A. Bessonova, Liudmila A. Kartsova, Valeria F. Gallyamova, Andrey V. Nikolaev, Ekaterina V. Obedkova Department of Chemistry - Saint-Petersburg St. Univ., Universitetskii pr. 26, Peterhof, 198504 Saint-Petersburg, Russia (Russian Fed.) 62 H.03 INTERACTION OF GLAUCOMA DRUGS WITH BIOMIMETIC MEMBRANES USING LIPOSOME ELECTROKINETIC CHROMATOGRAPHY Antti H. Rantamäki1, Suvi-Katriina Ruokonen1, Joanna Witos1, Alexandra Robciuc2, Juha M. Holopainen2, Susanne K. Wiedmer1 1 Department of Chemistry - University of Helsinki, A.I. Virtasen Aukio 1, 00014 Helsinki, Finland 2 Helsinki Eye Lab, Department of Ophthalmology - University of Helsinki and Helsinki University Hospital, Haartmaninkatu 4C, 00290 Helsinki, Finland H.04 APPLICATION OF OLIGOSACCHARIDE-CROWNED HYPERBRANCHED POLY(ETHYLENE IMINE)S AS CHIRAL SELECTORS IN HIGH PERFORMANCE LIQUID CHROMATOGRAPHY (HPTLC) AND AS COATING MATERIALS IN CAPILLARY ELECTROPHORESIS (CE) Daria V. Dzema, Liudmila A. Kartsova, Diana A. Kapizova Department of Chemistry - Saint-Petersburg State University, Universitetskii pr. 26, Peterhof, 198504 SaintPetersburg, Russia (Russian Fed.) H.05 IONIC LIQUIDS BASED ON IMIDAZOLIUM ARE MODIFIERS OF ELECTROPHORETIC SYSTEMS AND EXTRACTANTS AT DETERMINATION OF AMINO ACIDS AND STEROID HORMONES IN URINE Ekaterina A. Kolobova, Liudmila A. Kartsova, Elena A. Bessonova Institute of Chemistry - Saint-Petersburg State University, Petrodvorets, Universitetskii pr. 26, 198504 SaintPetersburg, Russia (Russian Fed.) H.06 NEW METHODOLOGY FOR CAPILLARY ELECTROPHORESIS WITH ESI-MS DETECTION: ELECTROPHORETIC FOCUSING ON INVERSE ELECTROMIGRATION DISPERSION GRADIENT FOR HIGH SENSITIVITY ANALYSIS OF SULFONAMIDES IN WATERS Zdena Malá, Petr Gebauer, Petr Bocek Institute of Analytical Chemistry of the CAS, v. v. i., Veveri 97, 60200 Brno, Czech Republic H.07 MONITORING BIOMASS DEGRADATION, ISOMERIZATION OF GLUCOSE TO FRUCTOSE AND CONVERSION TO 5-HMF IN IONIC LIQUIDS BY CE Tiina Aid, Margus Lopp, Merike Vaher Institute of Chemistry - Tallinn University of Technology, Akadeemia tee 15, 12618 Tallinn, Estonia H.08 COMPARISON OF LIPOSOME- AND OCTANOL-WATER DISTRIBUTION CONSTANTS OF ANTIOXIDANTS Jana Vanova1,2, Petr Cesla1, Susanne K. Wiedmer2 1 Department of Analytical Chemistry - Faculty of Chemical Technology, University of Pardubice, Studentská 573, 532 10 Pardubice, Czech Republic 2 Department of Chemistry - University of Helsinki, POB 55, 00014 University of Helsinki Helsinki, Finland H.09 RAPID CAPILLARY ELECTROPHORESIS METHOD WITH LED-INDUCED NATIVE FLUORESCENCE DETECTION FOR THE ANALYSIS OF AMPHETAMINE AND COCAINE DERIVATIVES IN ORAL FLUID Anastassia Tretjakova, Jekaterina Mazina, Merike Vaher, Maria Kulp Institute of Chemistry - Tallinn University of Technology, Ehitajate tee 5, 12816 Tallinn, Estonia H.10 VARIOUS CAPILLARY COATINGS IN CAPILLARY ELECTROPHORESIS-BASED ENZYMATIC ASSAY OF CHLOROPHYLLASE Pawel M. Nowak1, Michal Wozniakiewicz1, Maciej Michalik2, Leszek Fiedor2, Pawel Koscielniak1 1 Department of Analytical Chemistry, Faculty of Chemistry - Jagiellonian University in Kraków, ul. Ingardena 3, 30-060 Kraków, Poland 2 Department of Plant Physiology and Biochemistry, Faculty of Biochemistry, Biophysics and Biotechnology Jagiellonian University in Kraków, ul. Gronostajowa 7, 30-387 Kraków, Poland 63 H.11 DIBLOCK COPOLYMERS STUDIED BY CAPILLARY ELECTROPHORESIS AND ASYMMETRICAL FLOW FIELD FLOW FRACTIONATION Joanna Witos, Erno Karjalainen, Heikki Tenhu, Susanne K. Wiedmer Department of Chemistry - University of Helsinki, A.I. Virtasen Aukio 1, 00014 Helsinki, Finland H.12 SYSTEMATIC OVERVIEW OF UV LIGHT-MEDIATED SYNTHESIS LUMINESCENT AQUEOUS QUANTUM DOTS CHARACTERIZED BY CE-LEDIF Lukas Nejdl1,2, Pavel Kopel1,2, Marketa Vaculovicova1,2, Vojtech Adam1,2 Department of Chemistry and Biochemistry - Mendel University in Brno, Zemendelska 1, 61300 Brno, Czech Republic 2 Central European Institute of Technology - Brno University of Technology, Purkynova 123, 61200 Brno, Czech Republic 1 _____________________________________________________________________________ I. INSTRUMENTATION AND AUTOMATION _____________________________________________________________________________ I.01 OPEN PROBE FAST GC-MS - REAL TIME ANALYSIS WITH SEPARATION Alexander B. Fialkov, Uri Keshet, Tal Alon, Aviv Amirav Chemistry - Tel Aviv University, Ramat Aviv, 69978 Tel Aviv, Israel I.02 WARPING-BASED STRATEGY FOR THE SYSTEMATIC DETERMINATION OF DISCRIMINATIVE FEATURES IN GC-MS DATA Clement Truan1,2, Said Abouelkaram2, Nathalie Kondjoyan2, Jérémy Ratel2, Christophe Peres3, Erwan Engel2 1 ANALYTISS, 89 rue des poissonniers, 75018 PARIS, France 2 INRA - UR370 Qualité des Produits Animaux, theix, 63122 saint genes champanelle, France 3 Laboratoire Parfums - CHANEL, 135 avenue Charles de Gaulle, 92200 Neuilly sur seine, France I.03 AUTOMATED MICRO SOLID PHASE CLEAN-UP OF QUECHERS EXTRACTS FOR PESTICIDE ANALYSIS Hans-Joachim Huebschmann1, Guenter Boehm1, Reto Bolliger1, Mark Hayward2 1 APAC - CTC Analytics AG, Industriestrasse 20, 4222 Zwingen, Switzerland 2 ITSP Solutions Inc., Northlake Drive, 212 Hartwell, United States I.04 CHEMSNIFF – A PORTABLE DIGITAL MS-BASED SNIFFER INSTRUMENT Sjaak de Koning1, Edwin Beekwilder1, Boris Brkic2, Sarfaraz Syed3 1 Da Vinci Laboratory Solutions, Cairostraat 10, 3047BC Rotterdam, Netherlands 2 Q-Technologies, Brownlow Hill, L69 3GJ Liverpool, United Kingdom 3 Amsterdam Scientific Instruments, Science Park 105, 1098XG Amsterdam, Netherlands I.05 SEGMENTED TOTAL ION SPECTRA (STIS): A PRE-PROCESSING STEP FOR GC-MS DATA FOR CHEMOMETRIC ANALYSIS OF ARSON DATA Lawrence A. Adutwum, James J. Harynuk Chemistry - University of Alberta, 11227 Saskatchewan Drive, T6G2G2 Edmonton, AB, Canada 64 I.06 255 nm AND 280 nm UV-LED BASED PHOTOMETRIC DETECTION INTEGRATED WITH ZCELL FOR CAPILLARY LC Yan Li1, Pavel N. Nesterenko1, Roger Stanley2, Brett Paull1, Mirek Macka3 School of Physical Sciences and Australian Centre for Research on Separation Science (ACROSS) - University of Tasmania, Private Bag 75, 7001 Hobart, Australia 2 Centre for Forensic Science - University of Tasmania, Locked Bag 1370, 7052 Launceston, Australia 3 Chemistry - ACROSS - University of Tasmania (UTAS), Private Bag 75, 7001 Hobart, Australia 1 I.07 THE USAGE OF A DIRECT INLET PROBE IN COMBINATION WITH HIGH RESOLUTION MASS SPECTROMETRY FOR THE FAST ANALYSIS OF SOLID AND LIQUID SAMPLES Juergen Wendt Leco EATC, Berlin, D-10589 Berlin, Germany I.08 DETERMINATION OF THE FAT CONTENT PROFILE OF DIFFERENT CHOCOLATE PRODUCTS USING AN AUTOMATED WORKFLOW FOR THE GENERATION OF FATTY ACID METHYL ESTERS (FAME) Guenter Boehm, Reto Bolliger, Hans-Joachim Huebschmann CTC Analytics AG, Industriestrasse 20, 4222 Zwingen, Switzerland I.09 RAPID PORTABLE GC-MS ANALYSIS FOR ON-SITE SCREENING OF PHYTOCHEMICAL LEAF OILS IN AN AUSTRALIAN NATIVE BOTANIC GARDEN Yong Foo Wong1, Dandan Yan2,3, Humberto Bizzo4, Philip J. Marriott1 1 Monash University, Wellington Rd, 3800 Clayton, Australia 2 School of Physical Sciences - University of Tasmania, Sandy Point Road, 7001 Hobart, Australia 3 School of Chemistry - Monash University, Wellington Road, 3800 Clayton, Australia 4 Embrapa, Av. das Américas, 29501, 23020-470 Rio de Janeiro, Brazil I.10 A SIMPLE AND FLEXIBLE METHANIZER SOLUTION FOR LOW LEVEL CO/CO2 GAS ANALYSIS BY GAS CHROMATOGRAPHY Jaap de Zeeuw New products group - Restek Corp., weerhaan 9, 4336 KT 4336 KT Middelburg, Netherlands I.11 COMPACT ULTRAHIGH PRESSURE NANOFLOW LC SYSTEM Luke Tolley1, Milton Lee2, Xiaofeng Zhao2, Xiaofeng Xie2, Sonika Sharma2, Alex Plistil3, Hal Barnett3, Martin Brisbin3, Stanley D. Stearns3, Paul Farnsworth2, H. Dennis Tolley2 1 Chemistry - Southern Illinois University, 1245 Lincoln Dr., 62901 Carbondale, United States 2 Brigham Young University, Department of Chemistry, 84602 Provo, United States 3 VICI Valco Instruments, 8300 Waterbury, 77055 Houston, United States I.12 ON-LINE LIQUID ANALYSIS WITH A NEW GENERATION OF FAST MICRO-ANALYZER Adrien Maniquet Process Experimentation - IFPEN, Rond point de l'echangeur de Solaize, les levees, 69360 SOLAIZE, France I.13 SPECTRAL PROPERTIES OF ALLERGY SUBSTANCES IN FRAGRANCE CALCULATED FOR USE IN MULTIPHOTON IONIZATION MASS SPECTROMETRY Tomoko Imasaka1, Totaro Imasaka2 Graduate School of Design - Kyushu University, 4-9-1 Shiobaru, Minami-ku, 815-8540 Fukuoka, Japan 2 Department of Applied Chemistry, Graduate School of Engineering - Kyushu University, 744 Motooka, Nishi-ku, 819-0395 Fukuoka, Japan 1 65 _____________________________________________________________________________ J. COUPLED AND MULTIDIMENSIONAL TECHNIQUES _____________________________________________________________________________ J.01 CHALLENGING GC-MS APPLICATIONS ACHIEVED WITH COLD EI Aviv Amirav, Alexander B. Fialkov, Uri Keshet, Tal Alon Department of Chemistry - Tel Aviv University, Ramat Aviv, 69978 Tel Aviv, Israel J.02 SEPARATION, DETECTION, AND QUANTITATION OF INTACT PROTEINS BASED ON MULTIPLE REACTION MONITORING TRIPLE QUADRUPOLE MASS SPECTROMETRY Kevin A. Schug1, Evelyn H. Wang1, Frances Carroll2, Peter C. Combe3 Chemistry and Biochemistry - University of Texas at Arlington, 700 Planetarium PI., Box 19065, TX 76019-0065 Arlington, United States 2 Restek Corporation, 110 Benner Circle, 16823 Bellefonte, United States 3 Shimadzu Scientific Instruments, Inc., 7102 Riverwood Drive, 21046 Columbia, United States 1 J.03 DIRECT SPECIFIC ISOTOPIC ANALYSIS OF COMPOUNDS RELEASED BY PYROLYSIS (Py-CSIA): NOVEL APPLICATIONS IN PALEOENVIRONMENTAL STUDIES José M. De La Rosa1, Nicasio T. Jiménez-Morillo1, Ana Z. Miller1, Gonzalo Almendros2, José A. GonzálezPérez1 1 Instituto de Recursos Naturales y Agrobiología de Sevilla (IRNAS-CSIC), Reina Mercedes Av. 10., 41012 Seville, Spain 2 Museo Nacional de Ciencias Naturales (MNCN-CSIC), Serrano Street, 115b., 28006 Madrid, Spain J.04 IMPROVED QUANTITATIVE ANALYSIS OF PESTICIDES IN COMPLEX MATRICES THROUGH REDUCTION OF MATRIX SUPPRESSION AND INTERFERENCES BY MULTIDIMENSIONAL LIQUID CHROMATOGRAPHY COUPLED TO MASS SPECTROMETRY Nicola Cimino1, Stephan Buckenmaier2, Thomas Glauner2 Italia, Via V. Lamaro, 13, 00173 Roma, Italy 2 Agilent Technologies, Hewlett Packard Strasse 8, 76337 Waldbronn, Germany 1 Agilent J.05 COUPLING OF ION MOBILITY SPECTROMETRY AS DETECTOR TO A MICRO GAS CHROMATOGRAPH FOR ENHANCED DETECTION LIMITS AND APPLICABILITY Remko van Loon1, Nuria Sabugo Garcia2, Daniel Sanders2 Gas Phase Separations Division - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands Gesellschaft für Analytische Sensorsysteme, Otto-Hahn-Str. 15, 44227 Dortmund, Germany 1 2 J.06 HYDROCARBON CONTAMINANTS IN PIZZA BOXES FROM THE ITALIAN MARKET Sabrina Moret1, Claudia Picon2, Chiara Conchione2, Renzo Bortolomeazzi2 1 Food Science - University of Udine, Via Sondrio 2A, 33100 Udine, Italy 2 Department of Agricultural, Food, Environmental, Animal Sciences - University Udine, Via Sondrio 2A, 33100 Udine, Italy J.07 AUTOMATED SOLID PHASE EXTRACTION FOLLOWED BY ON-LINE LC-GC FOR CLASS SEPARATION OF AROMATICS IN EDIBLE OILS Sabrina Moret1, Chiara Conchione2, Lanfranco S. Conte2 1 Food Science - University of Udine, Via Sondrio 2A, 33100 Udine, Italy 2 Department of Agricultural, Food, Environmental, Animal Sciences - University Udine, Via Sondrio 2A, 33100 Udine, Italy 66 J.08 MZMINE AS A TOOL FOR THE OPTIMIZATION OF CHROMATOGRAPHIC AND MASSSPECTROMETRIC CONDITIONS TO IDENTIFY PHENOLIC COMPOUNDS IN COMPLEX PHYTOCHEMICAL MIXTURES Giorgia La Barbera, Anna Laura Capriotti, Patrizia Foglia, Susy Piovesana, Riccardo Zenezini Chiozzi, Aldo Laganà Dipartimento di Chimica - Sapienza Università di Roma, Piazzale Aldo Moro 5, 00185 Rome, Italy J.09 USE OF MULTIDIMENSIONAL GC AND SIMULTANEOUS SELECTIVE DETECTION TO RESOLVE COMPLEX MIXTURES Benjamin L'Homme, Erik Ritzen, John Mommers DSM Resolve, Urmonderbaan 22, 6167 Geleen, Netherlands J.10 A NOVEL MULTIDIMENSIONAL GAS CHROMATOGRAPHY SYSTEM FOR ON-LINE POSITION SPECIFIC STABLE ISOTOPE ANALYSIS OF ENVIRONMENTAL ORGANIC CONTAMINANTS Caroline Gauchotte-Lindsay1, Bryan White2 1 School of Engineering - University of Glasgow, Oakfield Avenue, G12 8LT Glasgow, United Kingdom 2 JSB United Kingdom and Ireland, Cedar Court Grove Park Business Est. White Waltham, SL6 3LW Maidenhead, United Kingdom J.11 USING THE SELF-CLEANING ION SOURCE TO EXTEND MAINTENANCE FREE GC/MS OPERATION Bruce Quimby1, Elizabeth Almasi1, Ken Brady2 Technologies, 2850 Centerville Road, 19808-1610 Wilmington, United States 2 Marketing Programs - Agilent Technologies, 5500 Lakeside, SK8 3GR Cheadle, United Kingdom 1 Agilent J.12 EFFICIENT REMOVAL OF OLEFIN INTERFERENCES BY ON-LINE LIQUID-LIQUID CHROMATOGRAPHY PRIOR TO THE GAS CHROMATOGRAPHY DETERMINATION OF MINERAL OIL CONTAMINATION IN VEGETABLE OILS Mariosimone Zoccali1, Giorgia Purcaro1, Laura Barp2, Marco Beccaria1, Danilo Sciarrone2, Luigi Mondello1,2 1 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy J.13 ISOLATION OF UNKNOWN MOLECULES FROM PLANT EXTRACTS EXPLOITING A MULTIDIMENSIONAL GC-PREP SYSTEM FOLLOWED BY NMR, MS AND FTIR FOR STRUCTURAL IDENTIFICATION Danilo Sciarrone1, Luigi Mondello1,2 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - Università degli studi di Messina, Viale Annunziata, 98168 Messina, Italy 2 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy J.14 SILICA MODIFIED WITH POLYMERIC AMPHIPHILIC NANOPARTICLES AS FIRST DIMENSION FOR MULTIDIMENSIONAL SEPARATION TECHNIQUES Rodrigo N. Padovan1, Anderson L. Luiz1, Maraíssa S. Franco1, Christopher Palmer2, Fernando M. Lancas1 Institute of Chemistry at Sao Carlos - University of Sao Paulo, 780, 13560-970 Sao Carlos, Brazil Department of Chemistry and Biochemostry - University of Montana, 32 Campus Drive Missoula, 59812 Montana, United States 1 2 J.15 DETERMINATION OF OCHRATOXIN A IN WINE BY IN-TUBE SOLID PHASE MICROEXTRACTION AND HIGH PERFORMANCE LIQUID CHROMATOGRAPHY WITH SEQUENTIAL MASS SPECTROMETRY DETECTION Mariane A. Andrade, Fernando M. Lancas Institute of Chemistry at Sao Carlos - University of Sao Paulo, Postal Code 780, 13560-970 Sao Carlos, Brazil 67 J.16 PHTHALIC ACID ESTERS DETERMINATION IN VEGETABLE OILS BY USING SPME FOLLOWED BY FAST GC COUPLED WITH TRIPLE QUADRUPOLE MS Flavio A. Franchina1, Laura Barp2, Mariosimone Zoccali1, Giorgia Purcaro1, Danilo Sciarrone2, Peter Q. Tranchida2, Luigi Mondello2,1 1 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Polo Annunziata, Viale Annunziata, 98168 Messina, Italy _____________________________________________________________________________ K. COMPREHENSIVE GC _____________________________________________________________________________ K.01 IMPACT OF DIVERSE MATRICES ON STANDARD METHODS EVALUATED BY OFFLINE HYPHENANTION OF HPLC-RI WITH GCxGC-TOFMS Maximilian K. Jennerwein1,2, Markus Eschner2, Thomas Gröger1, Thomas Wilharm2, Ralf Zimmermann1 1 Comprehensive Molecular Analytics - Helmholtz Zentrum München, Ingolstadter Landstraße 1, 85764 Munich, Germany 2 R&D - ASG Analytik Service Gesellschaft, Trentiner Ring 30, 86356 Neusäss, Germany K.02 TWO DIMENSIONAL GAS CHROMATOGRAPHY: A POWERFUL TOOL TO UNRAVEL WINE VOLATILES Katja Suklje1, Silvia Carlin2, Jan Stranstrup2, Guillaume Antalick1, Alain Deloire1, Urska Vrhovsek2, Leigh M. Schmidtke1 1 National Wine and Grape Industry Centre, Charles Sturt University, Locked Bag 588, 2678 Wagga Wagga, Australia 2 Department of Food Quality and Nutrition Department - Edmund Mach Foundation, Via E. Mach 1, 38010 San Michele a/A, Italy K.03 A NEW PASSIVE SAMPLER USING SILICONE RUBBER FOR THE ANALYSIS OF SURFACE WATER BY COMPREHENSIVE GAS CHROMATOGRAPHY – TIME OF FLIGHT MASS SPECTROMETRY Yvette Naudé1, Peter Gorst-Allman2, Egmont Rohwer1 Department of Chemistry - University of Pretoria, c/o Lynnwood Rd and Roper St, 83 Hatfield, Pretoria, South Africa 2 Separation Science - LECO Africa, Vuurslag Avenue, 1620 Kempton Park, South Africa 1 K.04 POTENTIAL OF GCxGC-ToF MS WITH SCRIPT FILTERS FOR THE IDENTIFICATION OF PERSISTENT ORGANOHALOGENATED POLLUTANTS IN TUNA SAMPLES Juan Escobar-Arnanz, Lourdes Ramos Dpt Instrum Anal & Environ Chem - IQOG-CSIC, Juan de la Cierva 3, 28006 Madrid, Spain K.05 COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY COUPLED TO TIMEOF-FLIGHT MASS SPECTROMETRY FOR THE ANALYSIS OF VAPOUR PHASE MAINSTREAM CIGARETTE SMOKE Benjamin Savareear1, Radoslaw Lizak1, Jean-Francois Focant1, Michal Brokl2, Christopher Wright2 1 Organic & Biological Analytical Chemistry Group - University of Liege, Allée du Six Août, 11, 4000 Liege, Belgium 2 British American Tobacco, Southampton, SO158TL Southampton, United Kingdom 68 K.06 GC×GC-TOF-MS BASED URINE METABOLOMICS IN PROSTATE CANCER Marta Kordalewska1, Renata Bujak1, Tomás Kovalczuk2, Agnieszka Ulanowska3, Grzegorz Straczynski3, Michal J. Markuszewski1 1 Department of Biopharmaceutics and Pharmacodynamics - Medical University of Gdansk, Hallera 107, 80-416 Gdansk, Poland 2 LECO Instrumente Plezen, Plaska 66, 32300 Plezen, Czech Republic 3 LECO Poland, Czarna 4, 43-100 Tychy, Poland K.07 COMPARISON OF GCXGC TOF MS AND GCXGC-HR MS FOR THE ANALYSIS OF ENVIRONMENTAL SAMPLES Els Van Meenen1, Thomas Groger2, Pieter Joos1,3, Benedikt Weggler2, Ralf Zimmermann2,4 1 Laboratory - water-link, Mechelsesteenweg 66, 2018 Antwerp, Belgium 2 Comprehensive Molecular Analytics, Ingolstaedter Landstrasse 1, 85764 Oberschleissheim, Germany 3 Department of Bioengineering - University of Antwerp, Groenenborgerlaan 171, 2020 Antwerpen, Belgium 4 Chair of Analytical Chemistry - Uinversity of Rostock, Dr. Lorenz Weg 1, 18051 Rostock, Germany K.08 PROFILING OF VOLATILE ORGANIC COMPOUNDS FROM CANOLA BY GCxGC-TOFMS James J. Harynuk1, Paulina A. de la Mata1, Chaminda S. Weeraddana2, Maya L. Evendon2, Lawrence A. Adutwum1 1 Department of Chemistry - University of Alberta, 11227 Saskatchewan Drive, T6G2G2 Edmonton, AB, Canada 2 Biological Sciences - University of Alberta, CW 405 Biological Sciences Bldg, T6H 3M8 Edmonton, AB, Canada K.09 LOW RESOLUTION, HIGH RESOLUTION, ACCURATE MASS, DECONVOLUTION! A COMPARISON OF LOW AND HIGH RESOLUTION GAS CHROMATOGRAPHY – TIME OF FLIGHT MASS SPECTROMETRY AND COMPREHENSIVE GAS CHROMATOGRAPHY – TIME OF FLIGHT MASS SPECTROMETRY Charles P. Gorst-Allman Separation Science - LECO Africa (Pty) Ltd, 3 Vuurslag Avenue, 1620 Spartan Ext.7, Kempton, South Africa K.10 GCXGC AS A TOOL FOR DISENTANGLING PETROLEUM REFINERY PROCESSES: 2STAGE HYDROTREATING_HYDROCRACKING Asger B. Hansen1, Asbjorn S. Andersen2, Rasmus G. Egeberg2 1 R&D Chemical Analytical - Haldor Topsoe AS, 55 Nymollevej, 2800 Lyngby, Denmark 2 R&D Refinery Processes, Haldor Topsoe AS, 55 Nymollevej, 2800 Kgs. Lyngby Copenhagen, Denmark K.11 MONITORING VOCS DURING BLOOD DEGRADATION BY TD-GC×GC-TOFMS WITH VARIABLE-ENERGY ELECTRON IONISATION Lena M. Dubois1, Katelynn A. Perrault1, Pierre-Hugues Stefanuto1, Stefan Koschinski2, Matthew Edwards3, Laura McGregor3, Jean-François Focant1 1 Department of Chemistry - University of Liège, Allée du 6 Août 11, B6c, 4000 Liège, Belgium 2 Markes International GmbH, Schleussnerstrasse 42, 63263 Frankfurt, Germany 3 Markes International Ltd., Gwaun Elai Medi-Science Campus, RCT Llantrisant, United Kingdom K.12 INVESTIGATION OF EMISSIONS FROM HEATED TOBACCO WITH COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY WITH MASS SPECTROMETRY DETECTION Radek Lizak1, Benjamin Savareear1, Michal Brokl2, Christopher Wright2, Jean-Francois Focant1 1 Organic and Biological Analytical Chemistry - University of Liege, Allée du 6 août, 11, B6c, Quartier Agora, B-4000 Liège (Sart-Tilman), Belgium 2 ADC Group Research and Development - British American Tobacco, Regents Park Road, Millbrook, Southampton, SO15 Southampton, United Kingdom 69 K.13 APPLICATION OF COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY-TIME OF FLIGHT MASS SPECTROMETRY FOR CHARACTERIZATION AT MOLECULAR LEVEL OF BRAZILIAN OIL Gabriela Vanini1, Vinícius B. Pereira1, Wanderson Romão2, Lize Mirela S. Oliveira3, Júlio César M. Dias3, Débora A. Azevedo1 1 Institute of Chemistry - Federal University of Rio de Janeiro, Av. Horácio Macedo, 1281, 21941598 Rio de Janeiro, Brazil 2 Federal Institute of Espírito Santo, Av. Ministro Salgado Filho, 1000, 29106010 Vila Velha, Brazil 3 Cenpes - Petrobrás, Ilha do Fundão, 21941915 Rio de Janeiro, Brazil K.14 UNDERSTANDING THE COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHIC DISCRIMINATION OF PETROLEUM HYDROCARBON STRUCTURES Daniela Franca, Bruno Q. Araújo, Jaakko Laakia, Francisco R. Aquino Neto, Debora A. Azevedo Institute of Chemistry - Federal University of Rio de Janeiro, Av. Horacio Macedo 1281, 21941598 Rio de Janeiro, Brazil K.15 SEPARATION AND QUANTIFICATION OF HYDROCARBON CLASSES IN CRUDE OIL USING COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY UNDER REVERSED-PHASE COLUMN SYSTEM Dayane M. Coutinho1, Daniela França1, Vinícius B. Pereira1, Lize Mirela S. de Oliveira2, Júlio César M. Dias2, Debora A. Azevedo1 1 Institute of Chemistry - Federal University of Rio de Janeiro, Av. Horácio Macedo 1281, 21941598 Rio de Janeiro, Brazil 2 Cenpes - PETROBRAS, Av. Horácio Macedo 950, 21941915 Rio de Janeiro, Brazil K.16 COMBINING MULTIDIMENSIONAL GAS CHROMATOGRAPHY-MASS SPECTROMETRY WITH HEART-CUTTING AND COMPREHENSIVE TWO DIMENSIONAL GAS CHROMATOGRAPHY FOR VOLATILE SAMPLE CHARACTERIZATION Davide Mendes1, Sofia Branco2, Eduardo Mateus2, Maria R. Paiva2, Marco Gomes da Silva1 1 LAQV, REQUIMTE, Departamento de Química - Faculdade de Ciências e Tecnologia da Universidade Nova de Lisboa, Campus da Caparica, 2829-516 Caparica, Portugal 2 CENCE - Faculdade de Ciências e Tecnologia da Universidade Nova de Lisboa, Campus da Caparica, 2829-516 Caparica, Portugal K.17 BIOMARKER DETECTION AND CHARACTERIZATION OF SMOKE FLAVORINGS BY HSSPME-GC×GC-TOF MS Anupam Giri1,2, Zuzana Zelinkova2, Thomas Wenzl2 1 Department of Chemistry - University of Liège, Allée du 6 août, 11, B6c, Quartier Agora, B-4000 Liège, Belgium 2 Institute for Reference Materials and Measurements - European Commission, Joint Research Centre, Retieseweg 111, B-2440 Geel, Belgium K.18 COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY COMBINED WITH HIGH-RESOLUTION MASS SPECTROMETRY: EXPLORING MASS DEFECT INFORMATION TO CHARACTERIZE BASE OIL Anupam Giri1, Marion Courtiade2, Amandine Racaud2, Jean-François Focant1 1 Department of Chemistry - University of Liège, Allée du 6 août, 11, B6c, Quartier Agora, B-4000 Liège, Belgium 2 Centre de Recherche de Solaize - Total Marketing Services, Chemin du Canal, BP 22, 69360 Solaize, France 70 K.19 TWO-DIMENSIONAL GAS CHROMATOGRAPHY TIME-OF-FLIGHT MASS SPECTROMETRY FOR THE INVESTIGATION OF PARTICULATE MATTER-BOUND ORGANIC COMPOUNDS DEPOSITED ON URBAN VEGETATION Ana Castanheiro1, Roeland Samson1, Pieter Joos2,3 1 Department of Bioscience Engineering - University of Antwerp, Groenenborgerlaan 171, 2020 Antwerp, Belgium 2 Laboratory - water-link, Mechelsesteenweg 64, 2018 Antwerp, Belgium 3 Department of Bioengineering - University of Antwerp, Groenenborgerlaan 171, 2020 Antwerpen, Belgium K.20 PEAK DISPERSION EVALUATION AND OPTIMIZATION IN GC×GC Pierre-Hugues Stefanuto1, Jean-Marie Dimandja2, Jean-François Focant1 1 Organic and Biological Analytical Chemistry Group, CART, Chemistry Department - University of Liège, Allée du six août B6c, 11, Quartier Agora, B-4000 Liège, Belgium 2 Department of Chemistry and Biochemistry - Spelman College, 350 Spelman Lane, 30314-4399 Atlanta, United States K.21 MULTIPLEXED DUAL DIMENSIONS COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY (2GC × 2GC) WITH CONTRA-DIRECTIONAL THERMAL MODULATION AND FLOW CONTROL Dandan Yan, Robert A. Shellie Australian Centre for Research on Separation Science - School of Physical Sciences, University of Tasmania, Private Bag 75, 7001 Hobart, TAS, Australia K.22 ANALYSIS OF CONTAMINANTS IN SURFACE WATER USING SPE–GC×GC–HR-TOF MS Sjaak de Koning1, Juergen Wendt2 1 Da Vinci Laboratory Solutions, Cairostraat 10, 3047BC Rotterdam, Netherlands 2 LECO Instruments, Marie-Bernays-Ring 31, 41199 Mönchengladbach, Germany K.23 ANALYSIS OF PYROLYSIS OILS ON GC-QTOF AND GCxGC-QTOF Mette Kristensen, Peter Christensen, Jan Christensen Department of Plant and Environmental Sciences - University of Copenhagen, Thorvaldsensvej 40, 1871 Frederiksberg C, Denmark K.24 POTENTIALS OF THE REVERSED-INJECT DIFFERENTIAL FLOW MODULATOR COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY IN THE QUANTITATIVE PROFILING OF SUSPECTED FRAGRANCE ALLERGENS Chiara Cordero1, Davide Bressanello1, Patrizia Rubiolo1, Luigi Cobelli2, Armando Miliazza3, Matthew Giardina4, Carlo Bicchi1 1 Dipartimento di Scienza e Tecnologia del Farmaco - University of Turin, Via Pietro Giuria, 9, I-10125 Turin, Italy 2 SRA Intruments SpA, Via alla Castellana 3, 20063 Cernusco sul Naviglio (Milan), Italy 3 Agilent Technologies, Cernusco sul Naviglio, 20063 Cernusco sul Naviglio (Milan), Italy 4 Gas Phase Separations Division - Agilent Technologies, 2850 Centerville Road, 19808 Wilmington, United States K.25 EXAMINATION OF HAFTING ADHESIVES ON PALEOLITHIC STONE TOOLS USING GC× GC-QTOFMS Katelynn A. Perrault1, Lena Dubois1, Pierre-Hugues Stefanuto1, Benjamin L'Homme2, Dries Cnuts3, Veerle Rots3, Jean-François Focant1 1 Organic and Biological Analytical Chemistry Group - University of Liège, Allée du 6 Août 11, B6c, Quartier Agora, 4000 Liège, Belgium 2 DSM Resolve, Urmonderbaan 22, 6167 Geleen, Netherlands 3 Prehistoric Archaeology/Traceolab - University of Liège, Quai Roosevelt 1B (Bât. A4), 4000 Liège, Belgium 71 K.26 OPTIMIZATION OF CADAVERIC INTERNAL GAS MONITORING BY GC×GC-HR ToF MS FOR USE IN POSTMORTEM EXAMINATIONS Katelynn A. Perrault1, Pierre-Hugues Stefanuto1, Lena Dubois1, Silke Grabherr2, Vincent Varlet3, Jean-François Focant1 1 Organic and Biological Analytical Chemistry Group - University of Liège, Allée du 6 Août 11, B6c, Quartier Agora, 4000 Liège, Belgium 2 Forensic Imaging Unit - University Center of Legal Medicine, Chemin de la Vulliette 4, CH-1000 Lausanne 25, Switzerland 3 Forensic Toxicology and Chemistry Unit - University Center of Legal Medicine, Chemin de la Vulliette 4, CH-1000 Lausanne 25, Switzerland K.27 GCxGC-QTOF: A COMPREHENSIVE APPROACH TO THE IDENTIFICATION CHALLENGES IN COMPLEX FOOD MATRICES Daniela Peroni1,2 1 Zoex Europe, Traamstraat 15, 5611CM Eindhoven, Netherlands 2 JSB Nederland, Apolloweg 2B, 8239DA Lelystad, Netherlands K.28 DETAILED CHARACTERIZATION OF PETROCHEMICAL SAMPLES BY GCxGC-HR-TOF WITH ADVANCED DATA PROCESSING Tomas Kovalczuk LECO, Plaska 66, 32300 Plzen, Czech Republic K.29 TWO-DIMENSIONAL GAS CHROMATOGRAPHY FOR THE ANALYSIS OF ATMOSPHERIC HALOCARBONS Chang-Feng Ou-Yang1,2, Scott Hua2, Ming-Kai Teng2, Yu-Chieh Chou2, Wen-Tzu Liu2, Chieh-Heng Wang2, JiaLin Wang2 1 Department of Atmospheric Sciences - National Central University, No. 300, Zhongda Rd., 32001 Taoyuan, Taiwan 2 Department of Chemistry - National Central University, No. 300, Zhongda Rd., 32001 Taoyuan, Taiwan K.30 ANALYSIS OF PETROLEUM PRODUCTS USING COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY (GC×GC) WITH BOTH TIME OF FLIGHT MS AND FLAME IONIZATION DETECTORS Joe Binkley, Christina N. Kelly, Jonathan D. Byer LECO Corporation, 3000 Lakeview Avenue, 49085 Saint Joseph, MI, United States K.31 COMPARISON OF METABOLIC PROFILES OF LIVER BIOPSY SAMPLES AND MATCHING SERUM SAMPLES BY GC×GC-TOF Ismo Mattila1, Matej Oresic1, Hannele Yki-Järvinen2, Panu Luukkonen2, Sanja Sädevirta2, Marja Leivonen2, Johanna Arola2, Tuulia Hyötyläinen1 1 Steno Diabetes Center, Niels Steensens Vej 2, 2820 Gentofte, Denmark 2 University of Helsinki, Haartmaninkatu 8, 00290 Helsinki, Finland K.32 ANALYSIS OF VOLATILE AND SEMIVOLATILE FLAVOUR COMPONENTS IN CIGARETTES BY HS-SPME AND GCxGC-QTOF-MS Jorge Regueiro, Anupam Giri, Zuzana Zelinkova, Thomas Wenzl Standards for Food Bioscience - European Commission, Joint Research Centre, Retieseweg 111, 2440 Geel, Belgium K.33 GC-MS/MS ROUTINE QUANTITATION AND GC×GC-MS SCREENING FOR EMERGING POLLUTANTS IN ONE SINGLE INJECTION Philippe Mottay1, Jiri Ondrus2, Roger Simon1 Brechbuehler, Steinwiessenstrasse 3, 8952 Schlieren, Switzerland service de l'energie et de l'environnement de l'etat de Neuchatel, Rue du Tombet 24, 2034 Peseux, Switzerland 1 2 72 K.34 ANALYSIS OF URINE SRMS USING SOLID PHASE MICRO EXTRACTION, DYNAMIC HEADSPACE AND LIQUID INJECTION WITH COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY (GC×GC)-HIGH RESOLUTION TIME-OF-FLIGHT MASS SPECTROMETRY Joe Binkley, David E. Alonso, Jonathan D. Byer LECO Corporation, 3000 Lakeview Avenue, 49085 Saint Joseph, MI, United States K.35 NOVEL ANALYSIS METHOD OF VARIOUS ENVIRONMENTAL SAMPLES USING GC×GCHRMS WITH ENCODED FREQUENT PULSING™ Scott Pugh, Viatcheslav Artaev, Mark F. Merrick LECO Corporation, 3000 Lakeview Avenue, 49085 St. Joseph, MI, United States K.36 MULTIWAY TOOLS OF NON TARGET COMPOUNDS USING GC × GC-TOFMS DATA TO MODELING CRUDE OIL PROPERTIES Daniela L. Vale1, Paula F. de Aguiar1, Lize Mirela S. de Oliveira2, Julio Cesar M. Dias2, Debora Azevedo1 Institute of Chemistry - Federal University of Rio de Janeiro, Avenida Athos da Silveira Ramos, 149, 21941-909 Rio de Janeiro, Brazil 2 Petrobras/Cenpes, Av. Horácio Macedo, 21941-909 RIO DE JANEIRO, Brazil 1 K.37 ANALYSIS OF AROMATIC AMINES IN HUMAN URINE USING COMPREHENSIVE MULTIDIMENSIONAL GAS CHROMATOGRAPHY MASS SPECTROMETRY (GC×GC-QMS) Nerea Lorenzo Parodi, Torsten C. Schmidt Instrumental Analytical Chemistry - Faculty of Chemistry, Universitätsstraße 5, S05 V02 E31, 45141 Essen, Germany K.38 FAST AND SLOW PYROLYSIS OF COFFEE RESIDUES: CHARACTERIZATION OF THE BIOOIL BY GC×GC/qMS Ariel O. Celestino1, Nayna L. Sampaio1, Anne Raquel T. Cardoso1, Jaderson K. Schneider2, Maria Elisabete Machado2, Laiza C. Krause1, Elina B. Caramao2 1 Programa de Pós Graduação em Biotecnologia Industrial - Universidade Tiradentes, UNIT, av. Murilo Dantas, 300, 49032490 Aracaju, Brazil 2 Instituto de Quimica - UFRGS, av.Bento Goncalves,9500, 91510-960 Porto Alegre, Rs, Brazil K.39 INVESTIGATION OF THE POSSIBLE EFFECT OF SAMPLING ON HUMAN EXHALED BREATH SAMPLE INTEGRITY Romain Pesesse1, Pierre-Hugues Stefanuto1, Florence Shleich2, Marie-Alice Meuwis3, Edouard Louis3, Renaud Louis2, Jean-François Focant1 1 Organic and Biological Analytical Chemistry Group, CART - University of Liège, Allée du six août B6c, B-4000 Liège, Belgium 2 Pneumology and Allergology Unit - University Hospital Center, Avenue de l'hopital, 4000 Liège, Belgium 3 Gastroenterology, Hepatology and Digestive Oncology Unit - University Hospital Center, Avenue de l'hopital, 4000 liège, Belgium K.40 PHOTOIONIZATION AS A SOFT IONIZATION SOURCE FOR COMPREHENSIVE TWODIMENSIONAL GC (GC×GC) AND HIGH-RESOLUTION TOFMS Masaaki Ubukata1, Robert B. Cody1, A. J. Dane1, Toshiyuki Kato2, Masahiro Ito2, Bram van der Meer3, Junichi Osuga4, Jean-François Focant5 1 JEOL USA, Inc., 11 Dearborn Road, 01960 Peabody, United States 2 JEOL Ltd,., 3-1-2 Musashino, 196-8558 Akishima, Japan 3 JEOL (Europe) BV, Lireweg 4, 2153 Nieuw-Vennep, Netherlands 4 JEOL (Europe) SAS, Espace Claude Monet-1, allee de Giverny, 78290 Croissy-Sur-Seine, France 5 University of Liège, Bâtiment B6b, 4000 Liège, Belgium 73 K.41 INTERACTIVE TOOLS FOR OPTIMIZING BLOB DETECTION AND TEMPLATE MATCHING FOR COMPREHENSIVE TWO-DIMENSIONAL CHROMATOGRAPHY Qingping Tao1, Chase Heble1, Stephen Reichenbach2,1, Chiara Cordero3 1 GC Image, LLC, PO Box 57403, 68505-7403 Lincoln, United States 2 Computer Science & Engineering - University of Nebraska, 260 Avery, 68588-0115 Lincoln, United States 3 Universita degli Studi di Torino, Via Pietro Giuria, 9, I-10125 Torino, Italy K.42 CHARACTERIZATION OF SULFUR AND NITROGEN COMPOUNDS IN BRAZILIAN PETROLEUM DERIVATIVES USING IONIC LIQUID COLUMNS IN COMPREHENSIVE TWODIMENSIONAL GAS CHROMATOGRAPHY AND MASS SPECTROMETRIC DETECTION Fernando C. Fontanive1, Érica S. Silva1, Juliana M. da Silva2, Elina B. Caramão3, Claudia A. Zini1 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 2 Fundação Escola Técnica Liberato Salzano Vieira da Cunha, Rua Inconfidentes 395, 93340140 Novo Hamburgo, Brazil 3 UNIT, Avenida Murilo Dantas 300, 49032-490 Aracaju, Brazil 1 K.43 VOLATILES PROFILING FROM HIGH QUALITY COCOA SAMPLES AT EARLY STAGES OF TECHNOLOGICAL TREATMENT BY TWO-DIMENSIONAL COMPREHENSIVE GAS CHROMATOGRAPHY - MASS SPECTROMETRY Federico Magagna1, Erica Liberto1, Stephen E. Reichenbach2, Qingping Tao3, Carlo Bicchi1, Chiara Cordero1 1 Dipartimento di Scienza e Tecnologia del Farmaco - University of Turin, Via Pietro Giuria, 9, I-10125 Turin, Italy 2 Computer Science and Engineering Department, University of Nebraska, 1400 R Street, 68504 Lincoln, United States 3 GC Image LCC, 1400 R Street, 68504 Lincoln, United States K.44 COMPREHENSIVE GC×GC ANALYSIS OF HYDRAULIC FRACTURING ADDITIVES IN WASTEWATER FROM UNCONVENTIONAL GAS PRODUCTION Aileen Melsbach, Martin Elsner Institute of Groundwater Ecology - Helmholtz Zentrum München, Ingolstädter Landstrasse 1, D-85764 Neuherberg, Germany K.45 EFFICIENT GC×GC DATA TREATMENT WITH BARCHAN ALGORITHM (BLOB ALIGNMENT FOR ROBUST CHROMATOGRAPHIC ANALYSIS) AND ANCHOR POINTS Camille Couprie1, Maxime Moreaud1, Laurent Duval1, Sophie Hénon2, Vincent Souchon2 1 Mechatronics, Computer Science and Applied Mathematics Division - IFP Energies nouvelles, 1 et 4 avenue de Bois-Préau, 92852 Rueil-Malmaison, France 2 Physics and Analysis Division - IFP Energies nouvelles, Rond-point de l'échangeur de Solaize - BP3, 69360 Solaize, France K.46 GC×GC WITH SIMULTANEOUS MASS SPECTROMETRY/FLAME IONIZATION DETECTION FOR ROUTINE PETROCHEMICAL ANALYSES Nick Bukowski, Laura McGregor, Matthew Edwards, Massimo Santoro Markes International, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom K.47 COMPREHENSIVE CHARACTERISATION OF ESSENTIAL OILS BY FLOW-MODULATED GC×GC–TOF MS Laura McGregor, Matthew Edwards, Nick Bukowski, Massimo Santoro Markes International, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom K.48 WHAT'S IN YOUR MORNING DRINK? COMPREHENSIVE CHARACTERISATION OF COFFEE EXTRACTS BY GCxGC-TOF MS Laura McGregor1, Massimo Santoro1, Eligio Sebastiani2, Steve Smith1 1 Markes International, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom 2 SRA Instruments S.p.A, Via alla Castellana 3, 20063 Milan, Italy 74 K.49 USE OF COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY WITH MASS SPECTROMETRIC DETECTION TO IDENTIFY MISCELANEOUS AROMA DESCRIPTORS OBTAINED BY GAS CHROMATOGRAPHY-OLFACTOMETRY OF MERLOT WINES FROM CAMPANHA GAÚCHA Karine P. Nicolli1, Laura O. Lago2, Elina B. Caramão3, Celito C. Guerra4, Henrique P. dos Santos4, Aline B. Marques5, Juliane E. Welke1, Claudia A. Zini1 1 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 2 Instituto de Ciência e Tecnologia de Alimentos - UFRGS, Av. Bento Gonçalves 9500, 91501-970 Porto Alegre, Brazil 3 UNIT, Avenida Murilo Dantas 300, 49032-490 Aracaju, Brazil 4 Embrapa Uva e Vinho, Rua Livramento, n? 515, 95700-000 Aracaju, Brazil 5 Embrapa Semi-Árido, BR 428, km 152, Zona Rural, 56302-970 Petrolina, Brazil K.50 COMPREHENSIVE CHARACTERIZATION OF E-LIQUID VOLATILES BY SPME-GC×GCHRTOF/MS Anupam Giri1,2, Jorge Regueiro2, Thomas Wenzl2 1 Department of Chemistry - University of Liège, Allée du 6 août, 11, B6c, Quartier Agora, B-4000 Liège, Belgium 2 Institute for Reference Materials and Measurements - European Commission, Joint Research Centre, Retieseweg 111, B-2440 Geel, Belgium K.51 PRODUCT CONTROL USING DIFFERENTIAL GC/MS AND COMPREHENSIVE GCxGC/MS Marco Ruijken R&D - MsMetrix, Doornhoecklaan 81, 3601JT maarssen, Netherlands K.52 CANADIAN CRAFT BEER CHARACTERIZATION USING TD-GC×GC-TOFMS Pierre-Hugues Stefanuto1, Katelynn A. Perrault1, Lena Dubois1, Benjamin L'Homme1, Catherine Allen1, Caitriona Loughnane1, Nobuo Ochiai2, Jean-François Focant1 1 Organic and Biological Analytical Chemistry Group, CART, Chemistry Department - University of Liège, Allée du six août B6c, 11, Quartier Agora, B-4000 Liège, Belgium 2 Gerstel, 2-13-18 Nakame, Meguro-ku, Tokyo 152-0031, Japan K.53 PRESSURE TUNING OF THE FIRST DIMENSION COLUMN IN GC×GC Mohammad Sharif Khan, Sung-Tong Chin, Chadin Kulsing, Philip J. Marriott Department of Chemistry - Monash University, 17 Rainforest walk, 3800 Clayton, Australia K.54 USE OF COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY AND TANDEM MASS SPECTROMETRY FOR THE TARGETED AND UNTARGETED ANALYSIS OF PETROCHEMICAL SAMPLES Maria Elisabete Machado1,2, Marco Piparo3, Flavio A. Franchina4, Claudia Zini1, Elina B. Caramao1,2, Peter Q. Tranchida3, Luigi Mondello3,4 1 Instituto de Química - Universidade Federal do Rio Grande do Sul, Av. Bento Gonçalves, 9500 Porto Alegre, Brazil 2 Programa de Pós Graduação em Biotecnologia Industrial - Universidade Tiradentes, av. Murilo Dantas, 49032490 Aracaju, Brazil 3 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy 4 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 75 K.55 (LOW-)FLOW MODULATION COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY EXPERIMENTS UNDER DIFFERENT OUTLET PRESSURE CONDITIONS Thiago R. Bjerk1, Mariarosa Maimone2, Flavio A. Franchina3, Giorgia Purcaro3, Danilo Sciarrone2, Claudia Zini1, Peter Q. Tranchida2, Luigi Mondello2,3 1 Instituto de Química - Universidade Federal do Rio Grande do Sul, Av. Bento Gonçalves, 9500 Porto Alegre, Brazil 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Polo Annunziata - viale Annunziata, 98168 Messina, Italy 3 Chromaleont S.r.L., viale Boccetta 70, 98122 Messina, Italy K.56 INNER AND OUTER INFLUENCES ON WHITE WINE AGEING: REVEALING THEIR IMPACT BY MULTIVARIATE STATISTICAL PROFILING OF WINE AROMA COMPOUNDS BASED ON HS-SPME-GC×GC-qMS Ann-Katrin Walther1, Thomas Roos1, Christof Steingass2, Hans-Georg Schmarr1, Dominik Durner1,3 1 Institute for Viticulture and Oenology - Dienstleistungszentrum Ländlicher Raum Rheinpfalz, Breitenweg 71, 67435 Neustadt, Germany 2 Institute of Food Science and Biotechnology - Hohenheim University, Garbenstraße 25, 70599 Stuttgart, Germany 3 Department of Applied Logistics and Polymer Sciences - Hochschule Kaiserslautern, Carl-Schurz-Straße 10-16, 66953 Pirmasens, Germany K.57 GC×GC-HRTOFMS TO BETTER UNDERSTAND CLOAK-AND-DAGGER ACTIVITIES OF MADAGASCAR MANTELLA FROGS Pierre-Hugues Stefanuto1, Catherine Brasseur1, Cecchini Harisoa2, Marta Andriantsiferana2, Jean-Francois Focant1 1 Organic and Biological Analytical Chemistry Group, CART, Chemistry Department - University of Liège, Allée du six août B6c, 11, Quartier Agora, B-4000 Liège, Belgium 2 University of Antananarivo, Antananarivo, 1001 Antananarivo, Madagascar K.58 HIGH-TEMPERATURE GCXGC-TOFMS ANALYSIS AND TWO-DIMENSIONAL SIMULATED DISTILLATION OF CRUDE OILS Maximilian K. Jennerwein1,2, Markus Eschner2, Thomas Gröger1, Thomas Wilharm3, Ralf Zimmermann1 1 Comprehensive Molecular Analytics - Helmholtz Zentrum München, Ingolstadter Landstraße 1, 85764 Munich, Germany 2 R&D - ASG Analytik Service Gesellschaft, Trentiner Ring 30, 86356 Neusäss, Germany 3 Management - ASG Analytik Service Gesellschaft, Trentiner Ring 30, 86356 Neusäss, Germany K.59 CHARACTERIZATION OF SAFFRON AROMA PROFILE: COMPARISON AMONG PTR-TOFMS, HS-SPME-GC-MS AND HS-SPME-2DGC-MS/TOF Francesca Ieri1, Pamela Vignolini1, Fabio Villanelli2,3, Eligio Sebastiani2, Luca Calamai4, Elisa Masi5, Stefano Mancuso5, Annalisa Romani1,3 1 PHYTOLAB laboratory -DiSIA, University of Florence, 50100 Firenze, Italy 2 SRA INSTRUMENTS, Viale Assunta 101, 20063 Cernusco S/N Milano, Italy 3 QuMAP laboratory - PIN Polo Universitario Prato, Prato, 50019 Prato, Italy 4 CNR Consiglio Nazionale delle Ricerche, Sesto Fiorentino, 50019 Sesto Fiorentino, Italy 5 DISPAA, University of Florence, 50100 Firenze, Italy K.60 QUANTITATIVE AND QUALITATIVE NON-TARGETED ENVIRONMENTAL APPLICATIONS UTILIZING COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY - TIME-OFFLIGHT MASS SPECTROMETRY Matias Kopperi, Marja-Liisa Riekkola Department of Chemistry - University of Helsinki, A.I.Virtasen aukio 1, P.O.BOX 55, FI-00014 Helsinki, Finland 76 K.61 APPLICATION OF MULTI-DIMENSIONAL GAS CHROMATOGRAPHY MASS SPECTROMETRY TECHNIQUES TO EXPLAIN THE INCREASED SENSITIVITY OF ATLANTIC HADDOCK EMBRYOS TO CRUDE OIL POLLUTION Lisbet Soerensen1,2, Steven J. Rowland3, William Robson3, Andy M. Booth4, Svein A. Mjøs2, Sonnich Meier1 1 Department of Environmental Chemistry - Institute of Marine Research, P.O 1870 Nordnes, 5817 Bergen, Norway 2 Department of Chemistry - University of Bergen, P.O. 7800, 5020 Bergen, Norway 3 Petroleum & Environmental Geochemistry Group, Biogeochemistry Research Centre - University of Plymouth, Devon, PL4 8AA Plymouth, United Kingdom 4 Environmental Technology - SINTEF Materials and Chemistry, P.O. Box 4760 Sluppen, 7465 Trondheim, Norway K.62 GC-MS AND 2DGC-MS/TOF VOLATILE PROFILE OF MONOVARIETAL EXTRA VIRGIN OILVE OILS Luca Calamai1, Fabio Villanelli2, Francesca Ieri3, Stefano Mulas3, Eligio Sebastiani4, Annalisa Romani2,3 DISPAA, University of Florence, 50100 Firenze, Italy QuMAP Laboratory, PIN Polo Universitario Città di Prato, 59100 Prato, Italy 3 PHYTOLAB laboratory - DiSIA - University of Florence, Viale Morgagni 65, 50100 Firenze, Italy 4 SRA INSTRUMENTS, Viale Assunta 101, 20063 Cernusco S/N Milano, Italy 1 2 K.63 TOWARD DEVELOPING A TB BREATHALYZER Theodore R. Mellors1, Joanne L. Flynn2, Jaime Tomko2, Melanie O'Malley2, Charles A. Scanga2, Philana L. Lin3, Jane E. Hill1 1 School of Engineering - Dartmouth College, 14 Engineering Drive, 03755 Hanover, United States 2 University of Pittsburgh, 3501 5th Avenue, 15261 Pittsburgh, United States 3 Children's Hospital of UPMC, 4401 Penn Avenue, 15224 Pittsburgh, United States K.64 LOW EV FRAGMENTATION AS A COMPLEMENTARY TOOL FOR THE EXTENDED LIST OF SUSPECTED ALLERGENS BY GC×GC-TOFMS – APPLICATION TO ESSENTIAL OILS Thomas Dutriez1, Laetitia Duffour1, Diane Pétermann1, Laura McGregor2, Nick Bukowski2, Neil Owen3, Greg Adamson4 1 RAPS Analytical Laboratory - Givaudan, Chemin de la parfumerie 5, 1214 Vernier, Switzerland 2 Markes International Ltd, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom 3 Givaudan UK Ltd, Kennington Road Ashford Kent, TN24 0LT Ashford, United Kingdom 4 Givaudan Fragrances Corp., 717 Ridgedale Avenue, 07936 East Hanover Ridgedale, United States K.65 MULTIDIMENSIONAL GAS CHROMATOGRAPHIC ANALYSIS OF TRACE OXIDISED SPECIES IN THERMALLY STRESSED JET FUELS Renee Webster1,2 1 Australian Centre for Research on Separation Science, School of Chemistry - Monash University, Wellington Rd, 3800 Clayton, Australia 2 Defence Science Technology Group, 506 Lorimer St, 3207 Fisherman's Bend, Australia K.66 GC×GC-TOFMS FOR FORENSIC BLOOD VOC PROFILING Lena M. Dubois, Katelynn A. Perrault, Pierre-Hugues Stefanuto, Jean-François Focant Department of Chemistry - University of Liège, Allée du 6 Août 11, B6c, 4000 Liège, Belgium K.67 APPLICATION OF GC×GC-TOF/MS TO THE ASSESSMENT OF THE BIOACCESSIBILITY OF PCBs IN MEAT AFTER DIGESTION Christelle Planche1,2, Jérémy Ratel1, Frédéric Mercier1, Cheng Zhang1, Laurent Debrauwer2, Erwan Engel1 1 MASS group - INRA, UR370 QuaPA, 63123 Saint-Genes-Champanelle, France 2 MetaToul-MetaboHUB-AXIOM platform - INRA, UMR1331 TOXALIM, Research Centre in Food Toxicology, 31027 Toulouse, France 77 K.68 IDENTIFICATION OF FOOD CONTAMINANTS FROM HOT-MELT ADHESIVES BY GCXGCMS Martin Lommatzsch1, Maurus Biedermann2, Konrad Grob2, Thomas J. Simat1 1 Chair of Food Science and Food Contact Materials - TU Dresden, Bergstr. 66, 01062 Dresden, Germany 2 KLZH, Fehrenstr. 15, 8032 Zurich, Switzerland K.69 COMBINING UNI-AND MULTIVARTIATE STATISTICS FOR THE GAIN OF COMPREHENSIVE INSIGHT IN THE MOLECULAR COMPOSITION OF PARTICULATE MATTER FROM WOOD COMBUSTION USING TWO DIMENSIONAL GAS CHROMATOGRAPHY TIME-OF-FLIGHT MASS SPECTROMETRY Benedikt Weggler1, Saray LyVerdu1, Maximilian Jennerwein2, Ahmed A. Reda1, Juergen Orasche1, Thomas Groger1, Ralf Zimmermann1,3 1 Joint Mass Spectrometry Centre/Cooperation Group Comprehensive Molecular Analytics - Helmholtz Zentrum München, Ingolstädter Landstrasse 1, 85764 Neuherberg, Germany 2 Joint Mass Spectrometry Centre/Cooperation Group Comprehensive Molecular Analytics - Analytical Service Group, Trentiner Ring 30, 86356 Augsburg, Germany 3 Division of Analytical and Technical Chemistry - University of Rostock, Dr.-Lorenz-Weg 1, 18059 Rostock, Germany K.70 GC×GC-TOFMS FOR THE ANALYSIS OF ESPRESSO COFFEE VOLATILE COMPOUNDS: FROM POWDER TO THE BREW, FROM GLOBAL TO PARTICULAR Guido R. Lopes1, Andreia S. Ferreira1, Mariana Pinto1, Cláudia P. Passos1, Elisabete Coelho1, Carla Rodrigues2, Cláudia Figueira2, Manuel A. Coimbra1, Sílvia M. Rocha1 1 QOPNA - Department of Chemistry - University of Aveiro, Campus Universitário de Santiago, 3810-193 Aveiro, Portugal 2 Diverge, Grupo Nabeiro Innovation Center, Alameda dos Oceanos 65, 1.1, 1990-208 Lisboa, Portugal K.71 R2D2: AN R PACKAGE FOR THE AUTOMATIC PROFILING OF GC×GC-MS SAMPLES IN UNTARGETED METABOLOMICS Xavier Domingo-Almenara1, Alexandre Perera2, Gabriel Vivó-Truyols3, Jesus Brezmes1 1 Metabolomics Platform - DEEEA - Universitat Rovira i Virgili, c/ Paisos Catalans, 26, 43007 Tarragona, Spain 2 B2SLAB, Automatic Control Department - Universitat Politècnica de Catalunya, Campus Diagonal Sud, 08028 Barcelona, Spain 3 Analytical Chemistry Group, Van't Hoff Institute for Molecular Sciences - Universiteit van Amsterdam, Science Park 9046, 1098 WV Amsterdam, Netherlands K.72 FUNCTIONALIZED OCTATETRAYNE AS NOVEL CARBON MEDIA FOR COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY Jiayi Liu1, Susan V. Olesik1, Matthew Giardina2 Department of Chemistry and Biochemistry - The Ohio State University, 100 West 18th Avenue, 43210 Columbus, United States 2 GC&Workflow Automation - Agilent Technologies, 2850 Centerville Rd, 19808 Wilmington, United States 1 K.73 PYROLYSIS TWO-DIMENSIONAL GAS CHROMATOGRAPHY MASS SPECTROMETRY FOR IDENTIFICATION AND QUANTIFICATION OF POLYOLEFINS Eric Brander Analytical Technology - SABIC, Plasticslaan 1, 4600 AC Bergen op Zoom, Netherlands K.74 APPLICATION OF COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATORGAPHY MASS SPECTROMETRY FOR POLYMERS USING DIFFERENT SAMPLE INTRODUCTIONS Eric Brander Analytical Technology - SABIC, Plasticslaan 1, 4600 AC Bergen op Zoom, Netherlands 78 K.75 THE ANALYSIS OF VOCs IN INDOOR AIR SAMPLES USING TD-GC×GC-TOF-MS INVESTIGATION OF THE ORIGINS OF THE "SICK-BUILDING SYNDROME" Matyas Ripszam1, Ingrid Liljelind1, Peter Haglund2 1 Department of Occupational and Environmental Medicine - Umeå University, Norrlands Univeristetssjukhus Building 6B and 6H, 901 85 Umeå, Sweden 2 Department of Chemistry - Umeå University, Linnaeus väg 6, 901 87 Umeå, Sweden K.76 NEW EXPERIMENTS TO SHOW A PREDICTION MODEL FOR SIMULATION OF A CONTOUR PLOT FOR GC×GC ANALYSIS Jan Henk Marsman1,2, Gert-Jan Boer2, Léon Rohrbach1, Hero J. Heeres1 Chem. Engineering - University Groningen, Nijenborgh 4, 9747 AG Groningen, Netherlands 2 University Labs - CS Aspa, Hoevenkamp 5, 9461 HE Gieten, Netherlands 1 K.77 ANALYSIS OF AQUEOUS ENDOCRINE-DISRUPTING PESTICIDES BY GC-ECD WITH STIR BAR SORPTIVE EXTRACTION USING ELECTROSPUN NANOFIBER Jen F. Jen Department of Chemistry - National Chung Hsing University, , 402 Taichung City, Taiwan K.78 A NEW APPROACH TO CREATING MICROFLUIDIC FLOW SWITCHING DEVICES FOR COMPLEX CAPILLARY GC APPLICATIONS James McCurry, Heng He, Matthew Giardina Gas Phase Division - Agilent Technologies, 2850 Centerville Road, 19808 Wilmington, United States K.79 GAS VELOCITY CALCULATIONS IN A CHROMATOGRAPHIC SYSTEM: A CRITICAL TOOL TO OPTIMIZE MODULATION TIMES IN COMPREHENSIVE GAS CHROMATOGRAPHY USING FORWARD AND REVERSE FILL/FLUSH FLOW MODULATORS Marie Vaccaro1, Laurence Levacher2, Gaelle Jousset-Semard2, Valerie Agasse-Peulon1, Pascal Cardinael1 1 Sciences et Méthodes Séparatives - University of Rouen, rue Tesnière, 76821 Mont saint aignan, France 2 Total Research & Technology Gonfreville, BP 27, 76700 Harfleur, France K.80 ORGANOPHOSPHORUS PESTICIDE AND ESTER ANALYSIS BY USING COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY WITH FLAME PHOTOMETRIC DETECTION Xiangping Liu1, Dengkun Li1, Gavin Rose2, Philip J. Marriott3 Department of Pysical and Chemical Analysis - Nanjing municipal center of disease control and prevention, No 2, Street Zizhulin, Gulou district, Nanjing, Jiangsu, 210003 Nanjing, China 2 Department of Primary Industry Macleod Centre, Ernest Jones Drive, Macleod, 3085 Victoria, Australia 3 School of Chemistry - Monash University, Wellington Rd, 3800 Victoria, Australia 1 K.81 A STANDARDIZED STATIC IN VITRO DIGESTION PROTOCOL FOR THE ASSESSMENT OF THE BIOACCESSIBILITY OF FOOD CONTAMINANTS BY GCXGC-TOF/MS Jeremy Ratel1, Christelle Planche1,2, Cheng Zhang1, Frédéric Mercier1, Patrick Blinet1, Laurent Debrauwer2,3, Erwan Engel1 1 MASS Group - UR370 QuaPA - INRA, Centre INRA de Theix, 63122 Saint-Genes-Champanelle, France 2 Research Centre in Food Toxicology - MetaToul-MetaboHUB-AXIOM platform - UMR1331 TOXALIM - INRA, 180 Chemin de Tournefeuille, 31027 Toulouse, France 3 INPT - UPS - UMR 1331 - Université de Toulouse, 118 Route de Narbonne, 31062 Toulouse, France K.82 THE USE OF ACCURATE MASS SCRIPTING FUNCTIONS TO DETECT AND IDENTIFY NEW DISINFECTION BYPRODUCTS IN SWIMMING POOLS AND SPAS Jonathan D. Byer1, Eric J. Daiber2, Sridevi A. Ravuri2, Joe Binkley1, Susan D. Richardson2 1 LECO Corporation, 3000 Lakeview Avenue, 49085 Saint Joseph, United States 2 Department of Chemistry and Biochemistry - University of South Carolina, 631 Sumter Street, 29208 Columbia, United States 79 K.83 BREATH GAS MONITORING DURING AN ORAL GLUCOSE TOLERANCE TEST BY A COMBINED PTR-QUAD-MS/GC×GC–TOFMS APPROACH FOR THE VERIFICATION OF POTENTIAL VOLATILE BIOMARKERS Beate Gruber1, Stefan Keller2, Thomas Groger1,3, Georg Matuschek2, Ralf Zimmermann1,3 Comprehensive Molecular Analytics - HelmholtzZentrum münchen, Ingolstaedter Landstrasse 1, 85764 Neuherberg, Germany 2 Research Unit Medical Radiation Physics and Diagnostics - Helmholtz Zentrum München, Ingolstädter Landstr. 1, 85764 Neuherberg, Germany 3 Joint Mass Spectrometry Centre - University of Rostock, Dr. Lorenz Weg 1, 18059 Rostock, Germany 1 K.84 FLOW-MODULATED COMPREHENSIVE 2D GAS CHROMATOGRAPHY COMBINED WITH VACUUM ULTRAVIOLET DETECTOR FOR THE ANALYSIS OF COMPLEX MIXTURE Mariosimone Zoccali1, Margita Utczas1, Giorgia Purcaro1, Peter Q. Tranchida2, Kevin A. A. Schug3, Luigi Mondello1,2 1 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy 3 Chemistry and Biochemistry - University of Texas at Arlington, 700 Planetarium PI., Box 19065, TX 76019-0065 Arlington, United States _____________________________________________________________________________ K*. OTHER COMPREHENSIVE TECHNIQUES _____________________________________________________________________________ K*.01 COMPREHENSIVE TWO DIMENSIONAL LIQUID CHROMATOGRAPHY IN DETERMINATION OF PHOSPHOLIPIDS ISOLATED FROM EGG YOLK Justyna Walczak1, Szymon Bocian2, Boguslaw Buszewski2 Department of the Environmental Chemistry and Bioanalytics - Faculty of Chemistry, 7 Gagarin St., 87-100 Torun, Poland 2 Department of the Environmental Chemistry and Bioanalytics - Faculty of Chemistry, Nicolaus Copernicus University in Torun, 7 Gagarin St., 87-100 Torun, Poland 1 K*.02 COMPREHENSIVE LIPID PROFILING IN MUSSEL SAMPLES BY COMPREHENSIVE LIQUID CHROMATOGRAPHY-TANDEM MASS SPECTROMETRY Paola Donato1, Francesca Rigano2, Ambrogina Albergamo3, Francesco Cacciola1, Marco Beccaria2, Paola Dugo3,2, Luigi Mondello3,2 1 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Viale Consolare Valeria, 98125 Messina, Italy 2 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 3 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina - Polo Annunziata, Viale Annunziata, 98168 Messina, Italy K*.03 COMPREHENSIVE TWO-DIMENSIONAL LIQUID CHROMATOGRAPHY FOR CHARACTERIZATION OF FOOD CAROTENOIDS Domenica Mangraviti1, Francesco Cacciola2, Daniele Giuffrida2, Margita Utczas3, Paola Donato2, Paola Dugo1,3, Luigi Mondello1,3 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, Polo Annunziata, 98168 Messina, Italy 2 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, via Consolare Valeria, 98125 Messina, Italy 3 Chromaleont S.r.L., Viale Boccetta 70, 98100 Messina, Italy 80 K*.04 ON-LINE COUPLING OF ULTRA PERFORMANCE CONVERGENCE CHROMATOGRAPHY AND ULTRA HIGH PRESSURE LIQUID CHROMATOGRAPHY FOR BOOSTING ORTHOGONALITY IN COMPREHENSIVE SEPARATIONS Paola Donato1, Veronica Inferrera2, Daniele Giuffrida1, Francesco Cacciola1, Paola Dugo2,3, Luigi Mondello2,3 1 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, Via Consolare Valeria , 98125 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, viale Annunziata, 98168 Messina, Italy 3 Chromaleont S.r.L., viale Boccetta 70, 98122 Messina, Italy _____________________________________________________________________________ L. TRACE ANALYSIS _____________________________________________________________________________ L.01 SOLVENT EVOLUTION ASSESSMENT IN BLOCK COPOLYMER ULTRATHIN FILMS FOR NANO-TECHNOLOGICAL APPLICATIONS Valentina Gianotti1, Diego Antonioli1, Katia Sparnacci1, Michele Laus1, Tommaso J. Giammaria2, Monica Ceresoli2, Gabriele Seguini2, Michele Perego2 1 DISAV Dipartimento di Scienze dell'Ambiente e della Vita - University of Piemonte Orientale, Viale T. Michel 11, 15121 Alessandria, Italy 2 Laboratory MDM - IMM-CNR, Agrate Brianza, 20864 Agrate Brianza, Italy L.02 OCURRANCE OF ANTIHYPERTENSIVE DRUGS BY SPE-GC/MS-MS IN SURFACE WATER IN SOUTH REGION OF BRAZIL Rodrigo A. Osawa1,2, Alessandra H. Ide1,3, Júlio César R. De Azevedo4 1 Department of Chemistry and Biochemistry - Faculty of Sciences University of Lisbon, R. Ernesto de Vasconcelos, 1749-016 Lisbon, Portugal 2 Graduate Program on Water Resources and Environmental Engineering - Federal University of Paraná, Caixa Postal 19011 – Jardim das Américas, 81531-990 Curitiba, Brazil 3 CAPES Foundation- Ministry of Education of Brazil, SBN, Quadra 02, Lote 06, Bloco L,, 70040-020 Brasília, Brazil 4 Graduate Program Environmental Science and Technology - Federal University of Technology - Paraná, Deputado Heitor de Alencar Furtado, 5000, 81280-340 Curitiba, Brazil L.03 FAST SCREENING, IDENTIFICATION AND QUANTIFICATION OF PESTICIDE RESIDUES IN BABY FOOD USING GC ORBITRAP MS TECHNOLOGY Dominic Roberts1, Cristian Cojocariu2, Richard Fussell2, Paul Silcock2, Mike Hetmanski3 1 GC-MS - Thermo Fisher Scientific, Tudor Road, WA7 1TA Runcorn, United Kingdom 2 Thermo Fisher Scientific, Manor Park, WA7 1TA Runcorn, United Kingdom 3 FERA, Sand Hutton, YO41 1LZ York, United Kingdom L.04 INSTRUMENT PERFORMANCE STANDARDS: QUICK AND EFFICENT TESTING OF GC/MS SENSITIVITY AND PERFORMANCE FOR THE ANALYSIS OF DIOXINS AND FURANS Dirk Krumwiede, Heinz Mehlmann Marketing - Thermo Fisher Scientific, Hanna-Kunath-Str. 11, 28199 Bremen, Germany L.05 USING GC-MS/MS AS A CONFIRMATORY METHOD FOR DIOXIN-LIKE PCBS IN FOOD AND FEED Dominic Roberts1, Esteban A. Holgado2, Cristian Cojocariu1, Inge d. Dobbeleer1 1 Thermo Fisher Scientific, Tudor Road, WA7 1TA Runcorn, United Kingdom 2 CSIC - Spanish Council for Scientific Research (CSIC), c/ Jordi Girona, 18-26, 08034 Barcelona, Spain 81 L.06 DOUBLED SAMPLE TROUGHPUT FOR DIOXINS AND OTHER POPS: THE DUAL DATA CONCEPT ON THE BASIS OF A DUAL GC MASS SPECTROMETER Heinz Mehlmann, Dirk Krumwiede POPs Center of Excellence - Thermo Fisher Scientific, Hanna-Kunath-Str. 11, 28199 Bremen, Germany L.07 IDENTIFICATION OF LEACHABLE IMPURITIES FROM PHARMACEUTICAL CONTAINER CLOSURE MATERIALS USING ORBITRAP BASED GC-MS Dominic Roberts1, Andrew Feilden2, Paul Silcock3, Kyle DSilva1, Richard Barlow2 1 GC-MS - Thermo Fisher Scientific, Tudor Road, WA7 1TA Runcorn, United Kingdom 2 Smithers RAPRA, Shawbury, SY4 4NR Shawbury, United Kingdom 3 Thermo Fisher Scientific, Tudor Road, WA7 1TA Runcorn, United Kingdom L.08 DETERMINATION OF THCCOOH TRACE IN HAIR WITH GCQQQ ACCORDING TO THE LOWEST LIMIT REQUESTED BY THE REGULATION Elena Ciceri, Inge de Dobbeleer, Tommaso Albertini, Andrea Caruso Thermo, Strada Rivoltana, 20090 Rodano (MI), Italy L.09 ANALYSIS OF MOSH AND MOAH IN PAPER-BASED PACKAGING MATERIAL USING GC– VUV Sjaak de Koning, Larissa Ram Da Vinci Laboratory Solutions, Cairostraat 10, 3047BC Rotterdam, Netherlands L.10 STUDY OF BIOGENIC VOLATILE ORGANIC COMPOUNDS (BVOCs) EMMITED FROM MYRTUS COMMUNIS L. GROWING IN ALGERIA Yazid Foudil-Cherif1, Noureddine Yassaa1,2 1 Faculté de Chimie, - USTHB, BP32, 16111 Bab-Ezzouar, Alger, Algeria 2 Centre de Développement des Energies Renouvelables - CDER, BP62 Route de l'Observatoire, Bouzareah, 16000 Algiers, Algeria L.11 RAPID HPLC DETERMINATION OF POLYCYCLIC AROMATIC HYDROCARBONS (PAHS) IN CHESTNUTS FLOUR Chiara Conchione1, Sabrina Moret1, Lanfranco S. Conte1, Jean Daniel Coisson2, Marco Arlorio2 1 Department of Agricultural, Food, Environmental and Animal Sciences - University of Udine, Via Sondrio 2A, 33100 Udine, Italy 2 Department of Pharmaceutical Sciences - University of Piemonte Orientale A. Avogadro, Largo Donegani 2, 28100 Novara, Italy L.12 GC-MS ANALYSIS OF PIMPINILLA ANISUM BIOACTIVE EXTRACTS: ANTIOXIDANT AND ANTIBACTERIAL ACTIVITIES Ali Boudina, Kaouthar Ayache, Soumia Boulahlib, Yazid Foudil-Cherif Chemistry - USTHB, El-Alia, BP 32 Bab-Ezzouar, Alger, Algeria L.13 TOWARDS ULTIMATE SENSITIVITY FOR THE ANALYSIS OF PERSISTENT ORGANIC POLLUTANTS (POPs) Francesca Rigano1, Jody Dunstan2, Francisco Ferron3, Davy Petit4, Luigi Mondello5,1 1 Chromaleont SrL, Viale Boccetta 70, 98122 Messina, Italy 2 Waters Corporation, Stamford Avenue, Altrincham Road, SK9 4AX Wilmslow, United Kingdom 3 Waters S.p.A., Viale dell'Innovazione 3, 20126 Milan, Italy 4 Waters S.A.S., BP 608, 78056 Saint-Quentin En Yvelines Cedex, France 5 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina - Polo Annunziata, Viale Annunziata, 98168 Messina, Italy 82 _____________________________________________________________________________ M. ENVIRONMENTAL APPLICATIONS _____________________________________________________________________________ M.01 DETERMINATION OF PCBs AND DDT IN BIOTA OF LAKE BAIKAL Olga V. Kustova, Alexander G. Gorshkov Laboratory of Chromatography - Limnological Institute Siberian Branch of Russian Academy of Sciences, 3, Ulan-Batorskaya St., P.O. Box 278, 664033 Irkutsk, Russia (Russian Fed.) M.02 UNRAVELLING THE PRESENCE OF ORGANIC COMPOUNDS IN MOONMILK FROM A LAVA CAVE BY ANALYTICAL PYROLYSIS (Py-GC/MS) Ana Z. Miller1, José M. De La Rosa1, José A. Gonzalez-Perez1, Nicasio T. Jiménez-Morillo1, Octavio Fernández2, Cesareo Saiz-Jimenez1 Instituto de Recursos Naturales y Agrobiología de Sevilla (IRNAS-CSIC), Reina Mercedes Av. 10., 41012 Seville, Spain 2 Grupo de Espeleología Tebexcorade La Palma, Santa Catalina, 14, 38700 S.C. La Palma, Spain 1 M.03 IDENTIFICATION OF EMERGING CONTAMINANTS IN THE ENVIRONMENT BY LC/Q-TOF MS USING SUSPECT AND NON-TARGET SCREENING WORKFLOWS COMBINED WITH COMMERCIAL AND OPEN-SOURCE MS/MS LIBRARIES Nicola Cimino1, Sascha Lege2, Jean Daniel Berset3, Thomas Glauner4, Christian Zwiener2 1 Agilent Italia, Via V. Lamaro, 13, 00173 Roma, Italy 2 Eberhard Karls University, Hölderlinstraße 12, 72074 Tuebingen, Germany 3 Water and Soil Protection Laboratory, Reiterstrasse 11, 3011 Bern, Switzerland 4 Agilent Technologies, Hewlett Packard Strasse 8, 76337 Waldbronn, Germany M.04 GC/MS SCREENING OF WATER SAMPLES FOR ORGANIC POLLUTANTS BY STIR BAR SORPTIVE EXTRACTION (SBSE) Oliver Lerch1, Jasmin Zboron1, Andreas Hoffmann1, Chris Sandy2 1 Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany 2 Agilent Technologies, 5500 Lakeside, Cheshire SK8 3GR Cheadle, United Kingdom M.05 DETERMINATION OF SOME EMERGING CONTAMINANTS IN FRESHWATER INVERTEBRATES USING A DEVELOPED QUECHERS EXTRACTION TECHNIQUE AND AN ADVANCED ORBITRAP SYSTEM Jalal T. Althakafy1,2, Chadin Kulsing1, Erinn Richmond3, Michael R. Grace3, Philip J. Marriott1 1 Australian Centre of Research on Separation Science, School of Chemistry, Faculty of Science - Monash University, VIC, 3800 Clayton, Australia 2 Department of Chemistry, Faculty of Applied Sciences - Umm Al-Qura University, Makkah, 21955 Makkah, Saudi Arabia 3 Water Studies Centre, School of Chemistry, Faculty of Science - Monash University, VIC, 3800 Clayton, Australia M.06 SPE-GC-MS/MS FOR THE DETERMINATION OF PHARMACEUTICAL AND PERSONAL CARE PRODUCTS IN BRAZILIAN WATERS Alessandra H. Ide1,2, Rodrigo A. Osawa2, Júlio César R. Azevedo3 1 Departamento de Química e Bioquímica - Faculdade de Ciências da Universidade de Lisboa, Campo Grande, Ed C8, 1749-016 Lisboa, Portugal 2 CAPES Foundation - Ministry of Education of Brazil, SBN, Quadra 02, Lote 06, Bloco L, 70040-020 Brasília, Brazil 3 UTFPR, Deputado Heitor Alencar Furtado, 4900, 81280-340 Curitiba, Brazil 83 M.07 DEVELOPMENT OF A LC-MS/MS METHOD FOR THE DETERMINATION OF NINE PHARMACEUTICAL COMPOUNDS IN SURFACE WATER SAMPLES Rodrigo A. Osawa1,2, Maria Helena Florêncio1, Maria Rosário Bronze3,4 1 Department of Chemistry and Biochemistry - Faculty of Sciences University of Lisbon, R. Ernesto de Vasconcelos, 1749-016 Lisbon, Portugal 2 CAPES Foundation- Ministry of Education of Brazil, SBN, Quadra 02, Lote 06, Bloco L, 70040-020 Brasília, Brazil 3 Institute for Experimental Biology and Technology, Apartado 12, 2780-901 Oeiras, Portugal 4 Faculty of Pharmacy University of Lisbon, Av. Prof. Gama Pinto, 1649-019 Lisbon, Portugal M.08 ENVIRONMENTAL FRIENDLY METHOD FOR MYCOTOXINS (AFB1 AND ZEA) DETERMINATION IN SOIL Nathalie Zamariola, Mary R. Marchi Department of Analitycal Chemistry - Institute of Chemistry, Unesp, Rua Prof. Francisco Degni, 55. Quitandinha, 14800-060 Araraquara, Brazil M.09 DETERMINATION OF TOTAL PETROLEUM HYDROCARBONS IN RUBBLE AND SOILS BY ACCELERATED SOLVENT EXTRACTION AND GC-FID Fabrizio Galbiati1, Luca Teli2, Inge d. Dobbeleer1 1 Thermo Fisher Scientific, Im Steingrund, 63303 Dreieich, Germany 2 Consulenze Ambientali SpA, Via A. Moro 1, 24020 Bergamo, Italy M.10 DETERMINATION OF POLYCHLORINATED BIPHENYLS (PCB) IN SOILS AND SOLID WASTE BY ACCELERATED SOLVENT EXTRACTION AND GC-MS/MS Elena Ciceri1, Fabrizio Galbiati2, Luca Teli3 1 Thermo, Strada Rivoltana, 20090 Rodano (MI), Italy 2 Thermo Fisher Scientific, Schweiz, 4153 AG, Reinach, Switzerland 3 Consulenze Ambientali SpA, Via Aldo Moro, 24020 Scanzorosciate, Italy M.11 SOURCE IDENTIFICATION OF BEACHED OIL AT AL ZUBARAH, NORTWESTERN QATAR Mette Kristensen1, Nasser S. Al-Kaabi2, Jan H. Christensen1 1 Department of Plant and Environmental Sciences - University of Copenhagen, Thorvaldsensvej 40, 1871 Frederiksberg C, Denmark 2 Department of Environmental Science - Qatar University, Al Tarfa, 2713 Doha, Qatar M.12 DETERMINATION OF PM2.5-BOUND POLYCYCLIC AROMATIC HYDROCARBONS AND OXYGENATED POLYCYCLIC AROMATIC HYDROCARBONS IN AN URBAN ENVIRONMENT Zoltán Nyiri1, Tamás Szigeti2, Márton Novák1, Bálint Sámuel Szabó1, Zsuzsanna Eke1,3 1 Joint Research and Training Laboratory on Separation Techniques - Eötvös Loránd University, Pázmány Péter sétány 1/A, 1117 Budapest, Hungary 2 Cooperative Research Centre for Environmental Sciences - Eötvös Loránd University, Pázmány Péter sétány 1/A, 1117 Budapest, Hungary 3 WESSLING International Research and Educational Center, Fóti út 56., 1047 Budapest, Hungary M.13 DETERMINATION OF BENZOTHIAZOLES, BENZOTRIAZOLES AND BENZENESULFONAMIDES IN MARINE ORGANISMS BY GAS CHROMATOGRAPHY-ION TRAP-TANDEM MASS SPECTROMETRY Laura Trabalón1, Martí Nadal2, Jose Luis Domingo2, Francesc Borrull1, Eva Pocurull1 Chemistry and Organic Chemistry - University Rovira i Virgili, Marcel-li Domingo s/n, 43007 Tarragona, Spain 2 Laboratory of Toxicology and Environmental Health - Universitat Rovira i Virgili, Sant Llorenç, 21, 43201 Reus, Spain 1 Analytical 84 M.14 INTERLABORATORY STUDY ON THE ANALYSIS OF CHLORINATED PARAFFINS IN ENVIRONMENTAL MATRICES Louise van Mourik1,2, Ike van der Veen1, Steven Crum3, Wim Cofino3, Jacob de Boer1 1 Institute for Environmental Studies (IVM) \ Chemistry & Biology - VU University, De Boelelaan 1087, 1081HV Amsterdam, Netherlands 2 National Research Centre for Environmental Toxicoligy (ENTOX) - University of Queensland, 39 kessels road, 4108 Coopers Plains, Australia 3 QUASIMEME Laboratory Performance Studies - Wageningen University and Research Centre, PO box 8005, 6700EC Wageningen, Netherlands M.15 INVESTIGATIONS ON THE METABOLISM OF PHARMACEUTICALS IN PLANTS Lisa Emhofer, Wolfgang Buchberger, Christian W. Klampfl Institute of Analytical Chemistry - Johannes Kepler-University, Austria, Altenbergerstr 69, 4040 Linz, Austria M.16 VERSATILE MAGNETIC CARBON NANOTUBES METHOD FOR THE DETERMINATION OF PESTICIDES IN REAL WATER SAMPLES BY GC/MS Frederico H. Barbosa1, Helvécio C. Menezes1, Ana Paula C. Teixeira1, Philippe Serp2, Zenilda L. Cardeal1 Department of Chemistry - Universidade Federal de Minas Gerais, Av. Antonio Carlos, 6627, 31270901 Belo Horizonte, Brazil 2 Université de Toulouse, UPS-INP-LCC 4 allée Emile Monso BP 44362, 31030 Toulouse, France 1 M.17 PASSIVE COLLECTION OF VOLATILE AND SEMI-VOLATILE COMPOUNDS IN AIR USING A NOVEL ADSORBENT SAMPLER WITH DIRECT, RAPID INJECTION INTO A CAPILLARY GCMS WITHOUT SECONDARY FOCUSING Daniel B. Cardin, Daniel J. Cardin, Thomas X. Robinson Analytical Instrumentation - Entech Instruments, Inc., 2207 Agate Ct., 93065 Simi Valley, United States M.18 IMPLEMENTATION AND VALIDATION OF AN ANALYTICAL PLATFORM TO ASSESS THE IMPACT OF TOBACCO PRODUCTS ON INDOOR AIR QUALITY Manuel Tharin, Emmanuel Rouget, Nicolas Mottier R&D - Philip Morris International, Quai Jeanrenaud 5, 2000 Neuchatel, Switzerland _____________________________________________________________________________ N. ENERGY, PETROCHEMISTRY AND INDUSTRIAL APPLICATIONS _____________________________________________________________________________ N.01 HPLC-MS AS IMPORTANT TOOL FOR THE ANALYSIS OF THE ANTIOXIDATIVE MECHANISM OF STABILIZERS IN ENGINE OILS Georg Kreisberger, Wolfgang Buchberger, Christian Klampfl Institue of Analytical Chemsitry - Johannes Kepler University, Altenbergerstrasse 69, 4040 Linz, Austria N.02 DEVELOPMENT OF ORIGINAL ANALYTICAL STRATEGIES FOR THE MONITORING OF GASEOUS EMISSIONS FROM SOLVENTS USED FOR CO2 CAPTURE PILOT PLANTS Lorena Cuccia1,2, José Dugay1, Domitille Bontemps3, Véronique Bellosta4, Myriam Louis-Louisy3, Jérôme Vial1 1 Laboratoire Sciences Analytiques Bioanalytiques et Miniaturisation (LSABM) - ESPCI ParisTech, 10 rue Vauquelin, 75005 Paris, France 2 ADEME, 20 avenue du Grésillé, 49004 Angers, France 3 EDF R&D, 6 quai Watier, 78401 Chatou, France 4 Laboratoire de Chimie Organique - ESPCI ParisTech, 10 rue Vauquelin, 75005 Paris, France 85 N.03 HPLC-MS AS A TOOL FOR STUDYING INTERACTIONS BETWEEN STABILIZERS USED IN PLASTIC MATERIALS Leila Maringer1, David Nitsche2, Wolfgang Buchberger1 1 Institute of Analytical Chemistry - Johannes Kepler University Linz, Altenberger Str. 69, 4040 Linz, Austria 2 AGRU Kunststofftechnik GmbH, Ing.-Pesendorfer-Straße 31, 4050 Bad Hall, Austria N.04 PDMS OVERCOATED SOLID PHASE MICRO EXTRACTION FILM IN DIRECT IMERSION MODE FOR THE CHARACTERIZATION OF PHENOLS IN AQUEOUS PHASE ORIGINATED FROM RESIDUAL BIOMASS PYROLYSIS Francieli M. Mayer1, Erica A. Souza-Silva1, Elina B. Caramão2, Claudia A. Zini1 1 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 2 UNIT, Avenida Murilo Dantas 300, 49032-490 Aracaju, Brazil N.05 PYROLYSIS OF MINERAL COAL: CHARACTERIZATION OF N-COMPOUNDS BY GC×GC/ qMS Jaqueline Franciele d. Teles1, Jefferson C. Almeida1, Bruna Onorevoli2, Juliana M. da Silva2, Maria Elisabete Machado2, Elina B. Caramao2 1 Programa de Pós Graduação em Biotecnologia Industrial - Universidade Tiradentes, UNIT, av. Murilo Dantas, 300, 49032490 Aracaju, Brazil 2 Instituto de Quimica - UFRGS, av.Bento Goncalves,9500, 91510-960 Porto Alegre, Rs, Brazil N.06 SAMPLE FLOW PATH DEACTIVATION FOR ANALYSIS OF LOW-PPM LEVELS OF ACTIVE SULFUR COMPOUNDS USING MICRO GAS CHROMATOGRAPHY Remko van Loon1, Coen Duvekot2 Gas Phase Separations Division - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands 2 Micro GC Product Marketing - Agilent Technologies, Herculesweg 8, 4338 PL Middelburg, Netherlands 1 N.07 HYPHENATION OF GC AND APCI-FT-ICR-MS FOR ANALYSIS OF PYROLYSIS OILS FROM A GERMAN BROWN COAL Jan Zuber, Marius Kroll, Philipp Rathsack, Matthias Otto Faculty of Chemistry and Physics - Institute of Analytical Chemistry, Leipziger Strasse 29, 09599 Freiberg, Germany N.08 DIATOSORB W, A NEW HIGH PERFORMANCE CHROMATOGRAPHIC DIATOMACEOUS EARTH USED AS SUPPORT IN PACKED COLUMNS Jaap de Zeeuw New products group - Restek Corp., weerhaan 9, 4336 KT 4336 KT Middelburg, Netherlands N.09 PYROLYSIS OF AGRO-INDUSTRIAL RESIDUES OF COFFEE, SUGARCANE STRAW AND COCONUT-FIBERS IN A SEMI-PILOT PLANT FOR PRODUCTION OF BIO-OILS: GASCHROMATOGRAPHIC CHARACTERIZATION Elina B. Caramao1, Mozart D. Bispo2, Laiza C. Krause2 1 Instituto de Quimica - UFRGS, av.Bento Goncalves,9500, 91510-960 Porto Alegre, Rs, Brazil 2 Unit, av. Murilo Dantas, 300, 49032-490 Aracaju, Brazil 86 _____________________________________________________________________________ O. BIOMEDICAL AND PHARMACEUTICAL APPLICATIONS _____________________________________________________________________________ O.01 NEW LIQUID PHASE MICROEXTRACTION METHOD TO ANALYZE BISPHENOL A AND PLASTICIZERS METABOLITES IN URINE SAMPLES USING GAS CHROMATOGRAPHY / MASS SPECTROMETRY Miriany Moreira1, Leiliane Andre2, Zenilda Cardeal1 1 Departament of Chemistry - UFMG, Av. Antonio Carlos, 6627, 31270010 Belo Horizonte, Brazil 2 Department of Clinical and Toxicological Analysis - UFMG, Av. Antonio Carlos, 6627, 31270010 Belo Horizonte, Brazil O.02 DISCRIMINATION AMONG DIFFERENT FORMS OF CANCER BASED ON URINARY VOLATOMIC COMPOSITION. THE CASE STUDY OF BREAST AND LUNG CANCERS Carina Cavaco1, Michael Caldeira1, Fernando Aveiro2, Jorge Pereira1, José S. Câmara1,3 Chemistry and Enology Lab - Centro de Química da Madeira, Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Centro Hospitalar do Funchal, Serviço de Hematoncologia, Avda. Luís de Camões, Nº 57, 9050-514 Funchal, Portugal 3 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 1 Analytical O.03 EXTRACTABLES AND LEACHABLES ANALYSIS OF IV BAG SYSTEMS USING THERMAL DESORPTION AND STIR BAR SORPTIVE EXTRACTION WITH GC SINGLE QUAD AND GC TIME-OF-FLIGHT MASS SPECTROMETRIC DETECTION Andreas Hoffmann1, Thomas Albinus1, Elizabeth Almasi2, Kurt Thaxton3 1 Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany 2 Agilent Technologies, 5301 Stevens Creek Boulevard, 95051 Santa Clara, United States 3 Gerstel, Inc., 701 Digital Drive, Suite J, 21090 Linthicum, United States O.04 FULLY AUTOMATED GC/MS DETERMINATION OF THC, CBN AND CBD IN HAIR BY GC/MS Oliver Lerch, Carlos Gil Analytical Services - Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany O.05 RAPID DETERMINATION OF DRUG PROTEIN BINDING AFFINITY USING SOLID PHASE MICROEXTRACTION (SPME) Len Sidisky, Emily Barrey, Craig Aurand Sigma Aldrich/ Supelco, 595 North Harrison Road, 16823 Bellefonte, United States O.06 ANALYSIS OF LIPID PROFILE IN HUMAN LIPID STORAGE MYOPATHIES Marco Beccaria1, Giorgia Purcaro1, Marianna Oteri2, Giuseppe Micalizzi1, Paola Dugo2,1, Luigi Mondello2,1 1 Chromaleont s.r.l., viale Boccetta, 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Viale Annunziata, 98168 Messina, Italy 87 O.07 SALIVARY VOLATOMIC PROFILES AS A POWERFUL AND NON-INVASIVE APPROACH TO DISCRIMINATE DIFFERENT FORMS OF CANCERS. A PRELIMINARY STUDY WITH BREAST AND LUNG CANCER PATIENTS Carina Cavaco1, Michael Caldeira1, Fernando Aveiro2, Jorge A. Pereira1, José S. Câmara1,3 1 Analytical Chemistry and Enology Lab - Centro de Química da Madeira, Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Centro Hospitalar do Funchal, Serviço de Hematoncologia, Avda. Luís de Camões, Nº 57, 9050-514 Funchal, Portugal 3 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal O.08 APPLICATION OF ZIC-HILIC AND RP MONOLITHIC SILICA CAPILLARIES IN LC-MS ANALYSIS OF BIOMOLECULES Vanessa Flink1, Stephan Altmaier1, Egidijus Machtejevas1, Klaus Buckendahl2, Frank Michel2, Anders Fridstrom3, Mike Buchanan4 Merck KGaA, Frankfurter Str. 250, 64293 Darmstadt, Germany 2 Sigma-Aldrich Chemie GmbH, Eschenstraße 5, 82024 Taufkirchen, Germany 3 Sigma-Aldrich International GmbH, Wassergasse 7, CH-9000 St. Gallen, Switzerland, CH-9000 St. Gallen, Switzerland St. Gallen, Switzerland, Switzerland 4 Sigma-Aldrich/Supelco, 595 N. Harrison Rd., 16823 Bellefonte, United States 1 O.09 HUMAN URINARY METABOLIC SIGNATURES BY PARALLEL DUAL SECONDARY COLUMN-DUAL DETECTION TWO-DIMENSIONAL COMPREHENSIVE GAS CHROMATOGRAPHY: RELIABLE TARGETED AND UNTARGETED COMPARATIVE ANALYSIS Davide Bressanello1,1, Erica Liberto1, Davis W. Rempe2, Qingping Tao3, Stephen E. Reichenbach2, Stefano Balducci4, Elisa Benetti1, Carlo Bicchi1, Chiara E. Cordero1 1 Dipartimento di Scienza e Tecnologia del Farmaco - University of Turin, Via Pietro Giuria, 9, I-10125 I-10125, Italy 2 Computer Science and Engineering Department - University of Nebraska, R Street, 1400 Lincoln, United States 3 GC Image LCC, PO Box, 57403 Lincoln, United States 4 La Sapienza University, Piazzale Aldo Moro 5, 00185 Roma, Italy O.10 ANALYTICAL METHODOLOGIES INVOLVED IN COMPREHENSIVE IDENTIFICATION OF GLYCANS IN HUMAN URINARY EXOSOMES Helena Soini, Guozhang Zou, Solomon T. Gizaw, Milos V. Novotny Department of Chemistry - Indiana University, 800 E Kirkwood Avenue, 47405-4001 Bloomington, IN, United States O.11 SCREENING OF TARGET BINDING OF IRREVERSIBLE JNK3 INHIBITORS ON PEPTIDE AND INTACT PROTEIN LEVEL BY MICROFLOW LC-QTOF-MS Adrian Sievers-Engler1, Felix Muth2, Silke M. Bauer2, Stefan Laufer2, Michael Lämmerhofer2 1 Institute of Pharmacy, Lämmerhofer Group - University of Tübingen, Auf der Morgenstelle 8, 72076 Tübingen, Germany 2 Institute of Pharmaceutical Sciences - University of Tübingen, Auf der Morgenstelle 8, 72076 Tübingen, Germany O.12 OBETICHOLIC ACID BIODISTRIBUTION AND METABOLISM IN CIRROTHIC RATS BY MEANS OF LIQUID CHROMATOGRAPHY-TANDEM MASS SPECTROMETRY ANALYSIS Aldo Roda1, Rita Aldini2, Cecilia Camborata1, Silvia Spinozzi1, Placido Franco1, Massimiliano Cont3, Antonietta D'Errico4, Francesco Vasuri4, Alessio Degiovanni4, Lorenzo Maroni4, Emanuele Porru1, Luciano Adorini5 1 Department of Chemistry - University of Bologna, Via Selmi 2, 40126 Bologna, Italy 2 Department of Pharmacy and Biotechnology - University of Bologna, Via S. Donato 15, 40126 Bologna, Italy 3 INBB, Viale delle Medaglie D'Oro, 305, 00136 Roma, Italy 4 DIMES Department - University of Bologna, Via Massarenti 9, 40138 Bologna, Italy 5 Intercept Pharmaceuticals, 450 W 15th Street, 10011 New York, United States 88 O.13 DETERMINATION OF METOPROLOL ENANTIOMERS IN HUMAN PLASMA AND SALIVA SAMPLES UTILIZING MICROEXTRACTION BY PACKED SORBENT AND LIQUID CHROMATOGRAPHY–TANDEM MASS SPECTROMETRY Hatem A. Elmongy, Mohamed Abdel-Rehim Department of Environmental Science and Analytical Chemistry - Stockholm University, Svante Arrhenius väg 16C, SE-10691 Stockholm, Sweden O.14 SIMPLE AND SENSITIVE METHOD FOR AMINO ACIDS ANALYSIS IN HUMAN CELLS USING LIQUID CHROMATOGRAPHY-ION-TRAP-TIME-OF-FLIGHT MASS SPECTROMETRY Eliane Nascimento1, Helvecio C. Menezes1, Rodrigo R. Resende2, Zenilda L. Cardeal1 1 Department of Chemistry - Universidade Federal de Minas Gerais, Av. Antonio Carlos, 6627, 31270901 Belo Horizonte, Brazil 2 Department of Biology - Universidade Federal de Minas Gerais, Av. Antonio Carlos, 6627, 31270901 Belo Horizonte, Brazil O.15 HIGH-THROUGHPUT SCREENING FOR DRUGS OF ABUSE AND PHARMACEUTICAL DRUGS IN HAIR BY LIQUID-CHROMATOGRAPHY-HIGH RESOLUTION MASS SPECTROMETRY (LC-HRMS) Sara Odoardi, Fabio De Giorgio, Sabina Strano-Rossi Institute of Public Health, Sction of Legal Medicine - Catholic University of Sacred Heart, L.go F. Vito, 1, 00168 Rome, Italy O.16 PERSPECTIVES ON TESTS AND MEASUREMENT FOR LEGAL PURPOSES: QUALITATIVE VALIDATION FOR CONFIRMATION OF SEIZED DRUGS BY GC-MS Adriaan A. Marais1, Johannes B. Laurens2 1 Forensic Chemistry Section - South African Police Service, 270 Pretoria Street, 0184 Pretoria, South Africa 2 Department of Chemistry - University of Pretoria, Lynnwood Road, 0002 Pretoria, South Africa O.17 HPLC-ESI-QTOF-MS/MS BASED METABOLIC PROFILING OF MAMMALIAN CELL LINES WITH DATA-INDEPENDENT SWATH ACQUISITION Corinna Sanwald, Michael Lämmerhofer Pharmaceutical (Bio)analysis - Institute of Pharmaceutical Sciences, University of Tuebingen, Auf der Morgenstelle 8, 72076 Tuebingen, Germany O.18 HPLC-MS TRACING OF SUBCLINICAL INFLAMMATION MOLECULAR MECHANISM IN ETHIOPATOGENESIS OF DM2 Petr Kacer, Marek Kuzma Department of Organic Technology - ICT-Prague, Technicka 5, 166 28 Prague 6, Czech Republic O.19 A POWERFUL STRATEGY BASED ON HS-SPME/GC-MS TO ESTABLISH THE VOLATOMIC PROFILE OF VACCINIUM PADIFOLIUM AT DIFFERENT RIPENING STAGES José A. Figueira1, Priscilla Porto-Figueira1, Jorge A. Pereira1, José S. Câmara1,2 1 Analytical Chemistry and Enology Lab - Centro de Química da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal O.20 AN EFFICIENT ANALYTICAL METHOD FOR DETERMINATION OF SPHENYLMERCAPTURIC ACID (SPMA) IN URINE BY HPLC FLUORIMETRIC DETECTOR TO ASSESSING BENZENE EXPOSURE Michele Mendes, Josianne N. Silveira, Leiliane Andre Department of Clinical and Toxicological Analysis - UFMG, Av. Antonio Carlos, 6627, 31270010 Belo Horizonte, Brazil 89 _____________________________________________________________________________ P. ANALYSIS OF NATURAL PRODUCTS, FOOD, FLAVOURS AND FRAGRANCES _____________________________________________________________________________ P.01 STUDY OF WINE AROMA RELEASE THROUGH CONSECUTIVE EXTRACTIONS DHS-TDGC-MS Yan Wen, Ricardo Lopez, Vicente Ferreira Laboratory for Flavor Analysis and Enology, Department of Analytical Chemistry - University of Zaragoza, Calle de Pedro Cerbuna, 12, 50009 Zaragoza, Spain P.02 GC-MS AND LC-ESI(+)-TOF-MS ANALYSIS OF TWO CHEMOTYPES FROM Lippia Origanoides ESSENTIAL OILS AND EXTRACTS Yuri Córdoba Campo1, Anderson Arias1,2, Jairo Martínez1,2, Elena Stashenko1,2 1 Research Center of Excellence-CENIVAM - Universidad Industrial de Santander, Carrera 27, Calle 9, Edificio 45, 680002 Bucaramanga, Colombia 2 Sede Bucaramanga - Universidad Industrial de Santander, Carrera 27, Calle 9, Edificio 45, 680002 Bucaramanga, Colombia P.03 ANALYSIS OF VOLATILE AND SEMI-VOLATILE COMPOUNDS IN GROUND BLACK PEPPER BY SOLID PROBE-GC/Q-TOF WITH NOVEL HIGH EFFICIENCY EI SOURCE Jennifer Sanderson1, Peter Gautschi1, Ken Brady2 Technologies, 5301 Stevens Creek Blvd, 95051-8059 Santa Clara, United States 2 Marketing Programs - Agilent Technologies, 5500 Lakeside, SK8 3GR Cheadle, United Kingdom 1 Agilent P.04 APPLICATION OF HS-SPME-GC-MS TO EVALUATE THE POSSIBLE INFLUENCE OF ALTITUDE ON APPLE FLAVOR Eugenio Aprea1, Maria Laura Corollaro2, Emanuela Betta1, Mathilde Charles1, Isabella Endrizzi1, Franco Biasioli1, Flavia Gasperi1 1 Food Quality and Nutrition - Fondazione Edmund Mach, Via E. Mach, 1, 38010 San Michele all'Adige, Italy 2 Eurofins Qualis S.r.l., corso Unione Sovietica 612/15B, 10135 Torino, Italy P.05 PHYTOCHEMICAL COMPOSITION BY SOLVENT FREE MICROWAVE EXTRACTION AND ANTIOXIDANT ACTIVITY INVESTIGATION OF ALGERIAN LAURUS NOBILIS L. LEAVES ESSENTIAL OILS Tazerouti Firouz Department of Chemistry - University of Science and Technology Houari Boumedien, LAOF, Fac Chemistry, USTHB, BP 32 El Alia Bab Ezzouar, 16111 Algiers, Algeria P.06 ON AQUEOUS REVERSED PHASE LIQUID CHROMATOGRAPHY-DIODE ARRAY DETECTION-LINEAR ION TRAP MASS SPECTROMETRY FOR A LARGE-SCALE PROFILING OF CAROTENOIDS IN SOME VARIETIES OF PEPPER (CAPSICUM ANNUUM L.) Alessandra Gentili, Virginia Perez-Fernandez, Roberta Curini Department of Chemistry - University of Rome La Sapienza, Piazzale Aldo Moro 5, 00185 Rome, Italy 90 P.07 EXPOSURE ASSESSMENT TO TOXIC ALDEHYDES PRODUCED DURING SYRAH WINEMAKING AND ANALYZED BY COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY WITH TIME-OF-FLIGHT MASS SPECTROMETRIC DETECTION Juliane E. Welke1, Karine P. Nicolli2, Laura O. Lago2, Aline B. Marques3, Elina B. Caramão4, Claudia A. Zini2 1 Instituto de Ciência e Tecnologia de Alimentos - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 2 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 3 Embrapa Semi-Árido, BR 428, km 152, Zona Rural, 56302-970 Petrolina, Brazil 4 UNIT, Avenida Murilo Dantas 300, 49032-490 Aracaju, Brazil P.08 COMPARISON OF NEW SPME ARROW AND CONVENTIONAL SPME IN THE ANALYSIS OF BEVERAGE FLAVOR PROFILE CHANGES Hendrik J. Schulte, Hans-Ulrich Baier, Stephane Moreau Product Marketing and Sales Support / MS Group - Shimadzu Europa GmbH, Albert-Hahn-Str. 6-10, 47269 Duisburg, Germany P.09 AROMAOFFICE: APPLICATION OF A NOVEL LINEAR RETENTION INDICES DATABASE TO A COMPLEX HOP ESSENTIAL OIL Kevin MacNamara1, Kikuo Sasamoto1, Nobuo Ochiai1, Andreas Hoffmann2, Robert Shellie3 1 Gerstel K.K., 1-3-1 Nakane, Meguro-ku, 152-0031 Tokyo, Japan 2 Gerstel GmbH & Co. KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany 3 Trajan Scientific and Medical, 7 Argent Place Ringwood, 3134 Victoria, Australia P.10 EFFECT OF ULTRASONIC PRE-TREATMENT ON AROMA-PROFILE OF APPLE SPIRITS Tomas Bajer, Petra Bajerová, Daniel Kremr, Ales Eisner, Karel Ventura Department of Analytical Chemistry - University of Pardubice, Faculty of Chemical Technology, Studentská 95, 53210 Pardubice, Czech Republic P.11 STUDY OF THE CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF FIVE SPECIES OF Lepechinia FROM COLOMBIA Diego C. Durán1, Jairo R. Martínez1, José L. Fernández2, Elena Stashenko1 1 Department of Chemistry - Universidad Industrial de Santander, Carrera 27 calle 9 UIS, 680002 Bucaramanga, Colombia 2 Institute of Natural Sciences - Universidad Nacional de Colombia, Carrera 30 calle 45 UNAL, 111321 Bogotá, Colombia P.12 QUANTITATIVE DETERMINATION OF PHYTOGENIC COMPOUNDS IN FEED BY GC-MS Georg Weingart, Klaus Teichmann, Gerd Schatzmayr, Ilse Dohnal Biomin Research Center - Biomin Holding GmbH, Technopark 1, 3430 Tulln, Austria P.13 ANALYSIS OF PLANAR PESTICIDES FROM SPINACH AND OTHER FOOD MATRICES USING QUECHERS CLEANUP WITH A NOVEL GRAPHITIZED CARBON BLACK AND ZIRCONIA-BASED ADSORBENT Patrick Myers1, Bill Betz1, Bill Ozanich1, Jennifer Claus1, Michael Ye1, Klaus Buckendahl2, Frank Michel2, Anders Fridstrom3, Mike Buchanan1 1 Sigma-Aldrich/Supelco, 595 N. Harrison Rd., 16823 Bellefonte, United States 2 Sigma-Aldrich Chemie GmbH, Eschenstraße 5, 82024 Taufkirchen, Germany 3 Sigma-Aldrich International GmbH, Wassergasse 7, CH-9000 St. Gallen, Switzerland P.14 WHAT CAN WE SMELL FROM WOOD? Daniel Kremr, Petra Bajerova, Tomas Bajer, Ales Eisner, Karel Ventura Department of Analytical Chemistry - University of Pardubice, Faculty of Chemical Technology, Studentská 573, 53210 Pardubice, Czech Republic 91 P.15 QUANTITATIVE ANALYSIS AND ENANTIODIFFERENTIATION OF WHISKY- AND COGNACLACTONE USING GAS CHROMATOGRAPHY WITH MASS SPECTROMETRIC DETECTION Hans-Georg Schmarr1, Marius S. Fraefel2, Maximilian Mathes1 1 Institute for Viticulture and Oenology - DLR Rheinpfalz, Breitenweg 71, 67435 Neustadt an der Weinstrasse, Germany 2 Faculty of Biotechnology - Applied Science University Mannheim, Paul-Wittsack-Straße 10, 68163 Mannheim, Germany P.16 COMBINATION OF DIFFERENT EXTRACTION (SFE, MSPD, SPME) AND CHROMATOGRAPHIC DETECTION TECHNIQUES (GC-MS, GC-MS/MS, LC-MS) FOR THE ANALYSIS OF COCA FLOWER SECONDARY METABOLITES Elena Stashenko, Deisy C. Bernal, Eduardo A. Solano, Fausto Prada, Jairo R. Martínez Cenivam-Chemistry - Industrial University of Santander, Building 45, Carrera 27 calle 9, 680002 Bucaramanga, Colombia P.17 STUDY OF THE VOLATILE CHEMICAL COMPOSITION OF RED WINES PRODUCED WITH PRE-FERMENTATION HEAT TREATMENT OF GRAPES Ricardo Lopez1, Olivier Geffroy2, Jean-Luc Favarel3, Vicente Ferreira1 1 Quimica Analitica - Universidad de Zaragoza, Pz. San Francisco, Facultad Ciencias (Edif. D), 50009 Zaragoza, Spain 2 Institut Français de la Vigne et du Vin Pôle Sud-Ouest, V'innopôle BP22, 81310 Lisle sur Tarn, France 3 Pera, Rue de la Métallurgie, 34510 Florensac, France P.18 UNTARGETED ANALYTICAL METHOD FOR GLYCOSYLATED SIMPLE PHENOL PROFILING BY ON-LINE SOLID PHASE EXTRACTION AND LC-HIGH RESOLUTION MASS SPECTROMETRY (Q-ORBITRAP) Chiara Barnaba, Tiziana Nardin, Davide Slaghenaufi, Giorgio Nicolini, Roberto Larcher IASMA Fondazione Edmund Mach, via E. Mach 1, 38010 San Michel a/A, Italy P.19 DETAILED ANALYSIS OF FAMES USING GC–VUV Sjaak de Koning, Larissa Ram Da Vinci Laboratory Solutions, Cairostraat 10, 3047BC Rotterdam, Netherlands P.20 AROMA ANALYSIS OF BEVERAGE SAMPLES USING THE MULTI-VOLATILE METHOD (MVM) FOR SEQUENTIAL DYNAMIC HEADSPACE GC/MS Thomas Albinus1, Andreas Hoffmann1,1, Jun Tsunokawa2, Kikuo Sasamoto2, Nobuo Ochiai2 1 Gerstel GmbH & Co.KG, Eberhard-Gerstel-Platz 1, 45473 Mülheim an der Ruhr, Germany 2 Gerstel K.K., 1-3-1 Nakane, Meguro-ku, 152-0031 Tokyo, Japan P.21 HUMAN SCENT SIGNATURE: AN OFF-LINE COUPLING OF GC WITH DOGS TO DETERMINE THE SCENT COMPOSITION AND ANALYSIS OF HUMAN SCENT SAMPLES BY GCXGC-MS Petr Dolezal1, Jana Lnenickova2, Petra Vyplelova2, Ludvik Pinc2, Pavlina Kyjakova3, Irena Valterova3, Veronika Skerikova1, Stepan Urban1 1 Department of Analytical Chemistry - University of Chemistry and Technology Prague (UCT Prague), Faculty of Chemical Engineering, Technicka 5, 166 28 Prague 6, Czech Republic 2 Canine Behavior Research Center - Department of Animal Science and Ethology, Czech University of Life Sciences Prague, Kamycká 129, 165 21 Prague, Czech Republic 3 Institute of Organic Chemistry and Biochemistry - Czech Academy Sciences, Flemingovo nám.2, 160 00 Prague 6, Czech Republic P.22 AUTHENTICATION OF MEDICINAL CANNABIS BY ELECTROPHORETIC FINGERPRINTS Jekaterina Mazina, Piret Saar-Reismaa, Maria Kuhtinskaja, Mihkel Kaljurand, Maria Kulp, Merike Vaher Institute of Chemistry - Tallinn University of Technology, Akadeemia tee 15, 12618 Tallinn, Estonia 92 P.23 VOLATILE PROFILE OF WOOD SPECIES FOR OENOLOGICAL PURPOSES BY PY-GC/MS Raquel Garcia1, Sérgio Martins2, Ana Manhita2, Cristina Barrocas Dias2,3, Maria Cabrita4 ICAAM,IIFA,Universidade de Évora, ap 94, 7006-554 Evora, Portugal Laboratório Hercules, Universidade de Évora, Largo Marques do Marialva, 7000-809 Evora, Portugal 3 Dep Quimica - Universidade de Evora, rua Romão Ramalho 59, 7000-671 Evora, Portugal 4 Instituto de Ciencias Agrárias e Ambientais Mediterranicas - Universidade Evora, Ap 94, 7002-554 Evora, Portugal 1 2 P.24 COMPARATIVE STUDY OF EXTRACTION METHODS AND ESSENTIAL OIL COMPOSITION FROM CARDAMOM SEEDS FROM FROM CARDAMOM FRUIT Djamila Fouial-Djebbar1, Imane Ourabia1, Madina Yassa1, Amira N. Kasdi1, Reda Djebbar2 Department of Chemistry, Faculty of Chemistry, Laboratory of Functional Organic Analysis - Houari Boumediene University of Sciences and Technology (U.S.T.H.B), BP 32 El-Alia, Bab-Ezzouar, 16111 Algiers, Algeria 2 Faculty of Biological Sciences - , Laboratory of Biology and Physiology of Organisms, Houari Boumediene University of Sciences and Technology (U.S.T.H.B), El Alia, BP 32, Bab Ezzouar, 16111 Algiers, Algeria 1 P.25 SCREENING FOR AROMA-ACTIVE COMPOUNDS IN THE AEREAL PARTS OF Heracleum transcaucasicum BY MEANS OF GC-OLFACTOMETRY AND AROMA EXTRACT DILUTION ANALYSIS Mariarosa Maimone1,2, Martin Steinhaus2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - Università degli Studi di Messina, Viale Annunziata, 98168 Messina, Italy 2 Deutsche Forschungsanstalt für Lebensmittelchemie - German Research Center for Food Chemistry, LiseMeitner-Straße 34, 85354 Freising, Germany 1 P.26 DYNAMIC HEADSPACE MULTI-VOLATILE METHOD (DHS-MVM) FOR CHARACTERIZATION OF AROMA COMPOUNDS IN BREAD AND BUTTER Jun Tsunokawa1, Nobuo Ochiai1, Kikuo Sasamoto1, Andreas Hoffmann2 1 Gerstel K.K., 1-3-1, Nakane, Meguro-ku,, 152-0031 Tokyo, Japan 2 GERSTEL GmbH & Co. KG, Eberhard-Gerstel-Platz 1, 45473 1, Muelheim an der Ruhr, Germany P.27 SOLVENT-ASSISTED STIR BAR SORPTIVE EXTRACTION (SA-SBSE) FOR WINE ANALYSIS: APPLICATION TO AROMA, OFF-FLAVOR, AND PESTICIDES Kikuo Sasamoto1, Nobuo Ochiai1, Frank David2, Pat Sandra2 1 Gerstel K.K., 1-3-1 Nakane, Meguro-ku, 152-0031 Tokyo, Japan 2 Research Institute for Chromatography, Kennedypark 26, 8500 Kortrijk, Belgium P.28 ANALYSIS OF WHISKEY LACTONE PRECURSORS IN OAK WOOD SAMPLES FROM THE PALATINATE FOREST WITH UHPLC-QTOF-MS Patricia Golombek1, Stefan Seegmüller2, Hans-Georg Schmarr1 Viticulture and Enology - DLR Rheinpfalz, Breitenweg 71, 67431 Neustadt an der Weinstrasse, Germany 2 Forschungsanstalt für Waldökologie und Forstwirtschaft RLP, Hauptstraße 16, 67705 Trippstadt, Germany 1 P.29 CYANOGENIC COMPOUNDS FROM MESOCARP AND EPICARP FLOURS OF PASSION FRUIT ( Passiflora edulis flavicarpa ) Humberto R. Bizzo1, Rosemar Antoniassi1, Adelia F. Faria-Machado1, Andrea M. Guedes1, Allan E. Wilhelm1, Eder D. Resende2, Simone V. Talma2 1 Embrapa Food Technology, Avenida das Américas, 29501, 23020-470 Rio de Janeiro, Brazil 2 CCTA/UENF, Av. Alberto Lamego, 2000, 28013-602 Campos, Brazil 93 P.30 SIMULTANEOUS DETERMINATION OF CAROTENOIDS AND TOCOCHROMANOLS FROM PALM HYBRID OIL BY HPLC WITH PHOTODIODE ARRAY AND FLUORESCENCE DETECTORS Humberto R. Bizzo, Adelia F. Faria-Machado, Andrea M. Guedes, Allan E. Wilhelm, Sidney Pacheco, Ronoel L. Godoy, Rosemar Antoniassi Embrapa Food Technology, Avenida das Américas, 29501, 23020-470 Rio de Janeiro, Brazil P.31 PURIFICATION AND IDENTIFICATION OF ENDOGENOUS ANTIOXIDANT AND ACEINHIBITORY PEPTIDES FROM DONKEY MILK BY MULTIDIMENSIONAL LIQUID CHROMATOGRAPHY AND NANOHPLC-HIGH RESOLUTION MASS SPECTROMETRY Riccardo Zenezini Chiozzi, Francesca Ferraris, Giorgia La Barbera, Susy Piovesana, Valentina Trionfera, Aldo Laganà Dipartimento di Chimica - Sapienza Università di Roma, Piazzale Aldo Moro 5, 185 Rome, Italy P.32 GC-MS DETERMINATION OF CYCLOPROPANE FATTY ACIDS TO ASSESS BEEF QUALITY Emanuele Sangiorgi, Elena Pellegrini, Ester C. Piccinelli Reparto Chimica Applicata alle Tecnologie Alimentari, Lombardia Emilia Romagna - Istituto Zooprofilattico Sperimentale, Via A. Bianchi 9, 25124 Brescia, Italy P.33 COFFEE AROMA INVESTIGATION: A CHEMOMETRIC COMPARISON OF THE INFORMATION PROVIDED BY THREE HCC SAMPLING TECHNIQUES ABLE TO CHEMICALLY DESCRIBE THE SENSORY PROPERTIES OF THE CUP Davide Bressanello1,1, Erica Liberto1, Patrizia Rubiolo1, Gloria Pellegrino2, Manuela R. Ruosi2, Carlo Bicchi1 1 Dipartimento di Scienza e Tecnologia del Farmaco - University of Turin, Via Pietro Giuria, 9, I-10125 I-10125, Italy 2 Lavazza Spa, Strada Settimo 410, 10156 Turin, Italy P.34 FATTY ACID AND ESSENTIAL OIL COMPOSITION OF PISTACIA TEREBINTHUS FRUITS Samira f. Mecherara-Idjeri1,2, Fatima-zohra Zebboudj2, Nour el islam Lazib2 1 Laboratoire de Recherche sur les Produits Bioactifs et la Valorisation de la Biomasse - Ecole Normale Supérieure (ENS), Vieux Kouba, 16000 Algiers, Algeria 2 Laboratoire d'Analyse Organique Fonctionnelle, Faculté de Chimie - USTHB, BP-32 El alia, 16004 Alger, Algeria P.35 APPLICATION OF AN IONIC LIQUID COLUMN TO THE ANALYSIS OF FLAVOR AND FRAGRANCE INGREDIENTS Nicole Curto, Nicholas Snow Department of Chemistry and Biochemistry - Seton Hall University, 400 S Orange Ave,, 07079 South Orange, United States P.36 COMPARISON OF THE AROMA PROFILES OF HOPS BY TD-GC-TOF MS Laura McGregor1, Massimo Santoro1, Nick Bukowski1, Gareth Roberts1, Stefan Koschinski2 1 Markes International, Gwaun Elai Medi-Science Campus, CF72 8XL Llantrisant, United Kingdom 2 Markes International GmbH, Schleussnerstrasse 42, 63263 Neu-Isenburg, Germany P.37 HPLC-PDA/ESI-MS ANALYSIS OF PHENOLIC COMPOUNDS IN LYCIUM BARBARUM L. FRUITS (GOJI BERRIES) AND EVALUATION OF ANTIOXIDANT ACTIVITY Giusy Tripodo, Marina Russo, Laura Dugo, Chiara Fanali Unit of Food Science and Nutrition, Department of Medicine - Campus Bio-Medico University, Via Alvaro del Portillo 21, 00128 Rome, Italy P.38 DIFFERENTIATING GOUDA TYPE CHEESES USING HEADSPACE GC-MS Asger Geppel Assays Department - Chr. Hansen A/S, Bøge Allé 10-12, DK-2970 Hørsholm, Denmark 94 P.39 DOES SEA LAMPREY HAVE A FATTY ACID SIGNATURE THAT REMAINS THROUGHOUT THE LIFE CYCLE? Eloi Martins1, Maria João Lança2, Pedro R. Almeida3, Marco Gomes da Silva1 1 Faculdade de Ciencias e Tecnologia - LAQV, REQUIMTE-DQ, Universidade Nova de Lisboa, 2829-516 Caparica, Portugal 2 ICAAM, Departamento de Zootecnia - Escola de Ciência e Tecnologia, Universidade de Évora, 7004-516 Évora, Portugal 3 MARE, Departamento de Biologia - Escola de Ciência e Tecnologia, Universidade de Évora, 7004-516 Évora, Portugal P.40 SCREENING FOR PESTICIDES RESIDUES IN COMPLEX FOOD MATRICES BY LC-MS/MS WITH AN AUTOMATED MASS SPECTRAL LIBRARY CONFIRMATION David R. Baker1, Neil Loftus1, Stephane Moreau2 Shimadzu Corporation, Trafford Wharf Road, Stretford, M17 1GP Manchester, United Kingdom MS Group - SHIMADZU Europa Gmbh, Albert Hahn Strasse 6-10, 47269 DUISBURG, Germany 1 2 P.41 ULTRA-SENSITIVE AND RAPID ASSAY OF NEONICOTINOIDS, FIPRONIL AND SOME METABOLITES IN HONEY BY UHPLC-MS/MS Mikaël Levi1, Aurore Jaffuel1, Stephane Moreau2 1 SHIMADZU France, Bd Salvador Allende, Noisiel, 77448 Marne la Vallée Cedex 2, France 2 MS Group - SHIMADZU Europa Gmbh, Albert Hahn Strasse 6-10, 47269 DUISBURG, Germany P.42 DEVELOPMENT AND VALIDATION OF AN HPLC-ES-MS/MS METHOD FOR THE STUDY OF PHARMACOKINETICS AND MASS BALANCE OF BERBERINE AND BERBERRUBINE IN RAT Emanuele Porru1, Placido Franco1, Silvia Spinozzi1, Massimiliano Cont2, Marinella Roberti3, Cristiana Caliceti1, Aldo Roda1 1 Department of Chemistry - University of Bologna, Via Selmi 2, 40126 Bologna, Italy 2 INBB, Viale delle Medaglie D'Oro, 305, 00136 Roma, Italy 3 Department of Pharmacy and Biotechnology - University of Bologna, Via Belmeloro, 6, 40126 Bologna, Italy P.43 IMPACT OF GCMS ANALYSIS FOR STUDY THE INFLUENCE OF EXTRACTING METHOD FOR THE EVALUATION OF THE ANTIOXIDANT ACTIVITY OF VOLATILE COMPOUNDS OF ZINGIBER OFFICINAL Lynda Boudarene, Lynda Boudarene, Sihem Aberrane, Sonia Amroun Faculty of Chemistry, University of Science and Technology Houari Boumedienne - USTHB, BP32, El Alia , BAB Ezzouar, 16111 Algiers, Algeria P.44 AN IMPROVED HS-SPME MDGC-MS/MS METHOD FOR THE ANALYSIS OF 2AMINOACETOPHENONE IN WINE Jutta Keiser, Susann Krautwald, Hans-Georg Schmarr Viticulture and Enology - DLR Rheinpfalz, Breitenweg 71, 67431 Neustadt an der Weinstrasse, Germany P.45 FAST ANALYSIS OF PHTHALATES IN FREEZE-DRIED BABY FOODS BY ULTRASOUNDVORTEX-ASSISTED LIQUID-LIQUID MICROEXTRACTION COUPLED WITH GC-IT/MS Mario Vincenzo Russo1, Pasquale Avino2, Ivan Notardonato1 1 Dipartimento Agricoltura, Ambiente e Alimenti - Università Degli Studi Del Molise, via De Sanctis, 86100 Campobasso, Italy 2 INAIL Research Area, via R. ferruzzi 38/40, 00143 Rome, Italy 95 P.46 ALTERATIONS OF PAPAYA ( CARICA PAPAYA L. CV. ´SOLO') VOLATILES DURING PURÉE PROCESSING Christof B. Steingass1, Veronika Lieb1, Hans-Georg Schmarr2,3, Reinhold Carle1,4 1 Institute of Food Science and Biotechnology (150d) - Hohenheim University, Garbenstrasse 25, 70599 Stuttgart, Germany 2 Institute for Viticulture and Oenology - DLR Rheinpfalz, Breitenweg 71, 67435 Neustadt, Germany 3 Instrumental Analytical Chemistry - University Duisburg-Essen, Universitätsstr. 5, 45141 Essen, Germany 4 Biological Science Department, Faculty of Science - King Abdulaziz University, P.O. Box 80257, 21589 Jeddah, Saudi Arabia P.47 HIGH RESOLUTION ACCURATE MASS (HRAM) GC-MS MEASUREMENTS FOR PHTHALATES CONTAMINATION ASSESSMENT IN WINE Elena Ciceri1, Inge de Dobbeleer1, Flavio Ciesa2, Luca D'Ambrosio2 1 Thermo, Strada Rivoltana, 20090 Rodano (MI), Italy 2 Laboratory of Food Analysis, Provincial Environment Agency, Amba Alagi Street 5, 39100 Bolzano, Italy P.48 METABOLOMIC PROFILING TO ASSESS ENVIRONMENTAL EFFECTS ON TEA QUALITY Albert Robbat1, Nicole Kfoury1, Amanda Kowalsick1, Colin Orians2, Sean B. Cash3, Timothy Griffin3, Selena Ahmed4, John R. Stepp5 1 Department of Chemistry - Tufts University, 62 Talbot Ave, 02155 Medford, United States 2 Department of Biology - Tufts University, 62 Talbot Ave, 02155 Medford, United States 3 Friedman School of Nutrition Science and Policy - Tufts University, 62 Talbot Ave, 02155 Medford, United States 4 Health and Humand Development - Montana State University, 345 Reid Hall, 59717 Bozeman, United States 5 Anthropology - University of Florida, 337 Turlington Hall, 32611 Gainsville, United States P.49 ASSESSMENT OF GC/MS BASED ANALYTICAL METHOD FOR 3-MCPD AND GLYCIDYL ESTERS ANALYSIS WITH SPECIAL EMPHASIS ON ARTEFACT FORMATION AND APPLICABILITY TO WIDE RANGE OF FOOD MATRICES Zuzana Zelinkova, Thomas Wenzl Standards for Food Bioscience - European Commission, Joint Research Centre, Retieseweg 111, 2440 Geel, Belgium P.50 DETERMINATION OF ESSENTIAL OIL COMPONENTS IN FEEDSTUFF ADDITIVES BY PRESSURIZED LIQUID EXTRACTION FOLLOWED BY GAS CHROMATOGRAPHY-MASS SPECTROMETRY Maria T. Tena, Marta Jimenez-Salcedo Department of Chemistry - University of La Rioja, Madre de Dios 53, E-26006 Logroño, Spain P.51 STUDY OF AMINOACIDS IN MERLOT GRAPES AND THEIR CORRESPONDING WINES USING LIQUID CHROMATOGRAPHY AND TANDEM MASS SPECTROMETRIC DETECTION AND OF THEIR RELATED ALCOHOLS WITH COMPREHENSIVE TWO-DIMENSIONAL GAS CHROMATOGRAPHY COUPLED TO TIME-OF-FLIGHT MASS SPECTROMETRIC DETECTION Karine P. Nicolli1, Laura O. Lago2, Celito C. Guerra3, Henrique P. dos Santos3, Rosângela A. Jacques1, Elina B. Caramão4, Juliane E. Welke2, Claudia A. Zini1 1 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 2 Instituto de Ciência e Tecnologia de Alimentos - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil 3 Embrapa Uva e Vinho, Rua Livramento, nº 515, 95700-000 Bento Gonçalves, Brazil 4 UNIT, Avenida Murilo Dantas 300, 49032-490 Aracaju, Brazil 96 P.52 ATMOSPHERIC PRESSURE GAS CHROMATOGRAPHY MASS SPECTROMETRY (APGCMS) BASED METABOLOMICS PROFILING OF GRAPE VOLATILES Vladimir Shulaev1, Manoj Ghaste1, Fulvio Mattivi2 1 Biological Sciences - University of North Texas, 1155 Union Circle #305220, 76203 Denton, United States 2 Department of Food Quality and Nutrition, Research and Innovation Centre - Fondazione Edmund Mach (FEM), Via E. Mach 1, 38010 San Michele all’Adige, Italy P.53 GC-MS IDENTIFICATION OF THE SECONDARY METABOLITES OF ESSENTIAL OILS OBTAINED FROM DAMIANA (TURNERA DIFFUSA) BY DISTILLATION TECHNIQUES Yuri Córdoba Campo1, Gustavo Rodríguez1,2, Jairo Martínez1,3, Elena Stashenko1,2 1 Research Center of Excellence-CENIVAM - Universidad Industrial de Santander, Carrera 27, Calle 9, Edificio 45, 680002 Bucaramanga, Colombia 2 Sede Bucaramanga - Universidad Industrial de Santander, Carrera 27, Calle 9, Edificio 45, 680002 Bucaramanga, Colombia 3 - Universidad Industrial de Santander, Carrera 27, Calle 9, Edificio 45, 680002 Bucaramanga, Colombia P.54 ANALYTICAL COMPARISON OF THE DETERMINATION OF BISPHENOL A AND BISPHENOL ANALOGUES IN PAPER PRODUCTS Andrea Jurek, Erich Leitner Institute of Analytical Chemistry and Food Chemistry - Graz University of Technology, Stremayrgasse 9/ II, 8010 Graz, Austria P.55 DISCRIMINATION OF DIFFERENT PASSIFLORA L. VARIETIES BASED ON VOLATOMIC PROFILE AND MULTIVARIATE ANALYSIS Priscilla Porto-Figueira1, Ana Freitas1, Catarina J. Cruz1, José A. Figueira1, Jorge A. Pereira1, José S. Câmara1,2 Chemistry and Enology Lab - Centro de Química da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 1 Analytical P.56 HS-SPME/GC-QMS COMBINED WITH MULTIVARIATE ANALYSIS AS A POWERFUL TOOL TO DISCRIMINATE BETWEEN EUGENIA UNIFLORA L. VARIETIES Priscilla Porto-Figueira1, José A. Figueira1, Jorge A. Pereira1, José S. Câmara1,2 1 Analytical Chemistry and Enology Lab - Centro de Química da Madeira, Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal 2 Faculdade de Ciências Exactas e da Engenharia - Universidade da Madeira, Campus da Penteada, 9000-390 Funchal, Portugal P.57 APPLICATION OF GAS CHROMATOGRAPHY COUPLED TO OLFACTOMETRY (GC-O), MASS SPECTROMETRY (GC/QMS) AND COMPREHENSIVE GAS CHROMATOGRAPHY (GC×GC/TOFMS) AS COMPLEMENTARY TOOLS TO ACCESS THE VOLATILE COMPOUNDS RESPONSIBLE FOR THE PECULIAR AROMA OF SYRAH WINE PRODUCED IN THE VALE OF SAO FRANCISCO REGION IN BRAZIL Janaína A. Barbará1, Érica S. Silva1, Elina B. Caramão2, Aline B. Marques3, Claudia A. Zini1 Chemistry Institute - UFRGS, Bento Goncalves, 9500, 91501-970 Porto Alegre, Brazil UNIT, Avenida Murilo Dantas 300, 49020290 Aracaju, Brazil 3 Embrpa Semi-Árido, BR 428, km 152, Zona Rural, 56302970 Petrolina, Brazil 1 2 P.58 EMBEDDED OF THE LINEAR RETENTION INDEX INFORMATION WITHIN A DEDICATED MS SPECTRA DATABASE TO BOOST THE IDENTIFICATION RELIABILITY OF COMPLEX SAMPLES IN THE FLAVOUR AND FRAGRANCE FIELD Margita Utczas1, Giuseppe Micalizzi1, Giorgia Purcaro1, Luigi Mondello1,2 1 Chromaleont SRL, Viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, - Polo Annunziata - viale Annunziata, 98168 Messina, Italy 97 P.59 EXPLOITATION OF DIFFERENT TECHNIQUES FOR A RELIABLE IDENTIFICATION OF UNKNOWN COMPOUNDS TO BE ADDED INTO A DEDICATED DATABASE FOR THE FLAVOUR AND FRAGRANCE FIELD Giuseppe Micalizzi1, Margita Utczas1, Giorgia Purcaro1, Danilo Sciarrone2, Luigi Mondello1,2 1 Chromaleont SrL, viale Boccetta 70, 98122 Messina, Italy 2 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, - Polo Annunziata - viale Annunziata, 98168 Messina, Italy P.60 EVALUATION OF THE LIPID PROFILE OF DAIRY PRODUCTS DURING AND AFTER THEIR SHELF-LIFE Marianna Oteri1, Marco Beccaria2, Giorgia Purcaro2, Giuseppe Micalizzi2, Ivana L. Bonaccorsi1, Francesco Cacciola3, Paola Dugo1,2, Luigi Mondello1,2 1 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - Università degli Studi di Messina, Viale Annunziata, 98168 Messina, Italy 2 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy 3 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - Università degli Studi di Messina, Via Consolare Valeria, 98125 Messina, Italy P.61 AZAPHILONES PIGMENTS FROM Talaromyces Albobiverticillius Miroslava Zelena1, Laurent Dufosse2, Daniele Giuffrida3, Francesco Cacciola3, Mekala Venkat2, Mireille Fouillaud2, Emmanuelle Girard-Valenciennes2, Lenka Ceslova1, Paola Dugo4,5, Luigi Mondello4,5 1 Department of Analytical Chemistry - Faculty of Chemical Technology - University of Pardubice, Studentská 573, 532 10 Pardubice, Czech Republic 2 Laboratoire de Chimie des Substances Naturelles et des Sciences des Aliments - LCSNSA EA 2212 Université de la Réunion, 15 Avenue René Cassin, CS 92003,Saint-Denis Cedex 9, F-97744 Ile de la Réunion, France 3 Dipartimento di Scienze Biomediche, Odontoiatriche e delle Immagini Morfologiche e Funzionali - University of Messina, via Consolare Valeria, 98125 Messina, Italy 4 Dipartimento di Scienze Chimiche, Biologiche, Farmaceutiche ed Ambientali - University of Messina, Via SS. Annunziata, 98168 Messina, Italy 5 Chromaleont S.r.L., Viale Boccetta 70, 98122 Messina, Italy P.62 CHEMICAL COMPOSITION OF ESSENTIAL OILS OF OLIVE LEAVES USING GC-MS AND EVALUATION OF ANTIOXIDANT ACTIVITY OF THEIR CRUDE EXTRACTS Linda Didaoui Ecole Nationale Polytechnique - ENP, BP 182 El Harrach, 16000 Algiers, Algeria P.63 HS-SPME-GC-MS METHOD FOR THE DETERMINATION OF EMERGING VOLATILE CONTAMINANTS IN FRUITS. Fabrizio Cincotta, Antonella Verzera, Concetta Condurso, Gianluca Tripodi Department of Chemical, Biological, Pharmaceutical and Environmental Sciences - University of Messina, Viale Stagno d'Alcontres 31, 98166 Messina, Italy _____________________________________________________________________________ Q. MICROFABRICATED CHIPS _____________________________________________________________________________ Q.01 CONVENTIONAL AND ENANTIOSELECTIVE GC WITH MICRO-FABRICATED PLANAR COLUMNS FOR ANALYSIS OF REAL-WORLD SAMPLES OF PLANT VOLATILE FRACTION Cecilia Cagliero1, Stefano Galli2, Mario Galli2, Chiara Cordero1, Erica Liberto1, Barbara Sgorbini1, Patrizia Rubiolo1, Carlo Bicchi1 1 Dipartimento di Scienza e Tecnologia del Farmaco - Università di Torino, Via Pietro Giuria, 9, 10125 Torino, Italy 2 MEGA s.n.c., Via Plinio, 29, 20025 Legnano, Italy 98 Q.02 CHIP-BASED HIGH-TEMPERATURE LIQUID CHROMATOGRAPHY FOR HIGH SPEED ANALYTICS Josef J. Heiland1, Carsten Lotter1, Volkmar Stein2, Detlev Belder1 1 Faculty of Chemistry and Mineralogy, Institute of Analytical Chemistry, Workgroup Prof. Dr. Belder - University of Leipzig, Linnéstrasse 3, 04177 Leipzig, Germany 2 Institute of Microtechnology Mainz (ICT-IMM) - Fraunhofer Institute for Chemical Technology, Carl-ZeissStrasse 18-20, 55129 Mainz, Germany 99