MONDAY, MAY 24Start the day at Waters Booth #83 Salt Palace Convention Center, 9:00 a.m. – 5:00 p.m.

ORALS Code Time LC/MS Challenges/Solutions for Monitoring of Human Metabolites in Safety Test (MIST) To the Detection and Quantification of Drug Metabolites Using the Simultaneous Collection of MRM and MS/MS Data: A Case Study Location: Hall 2 MOE pm 3:30 p.m.Qualitative Analysis of Protein Therapeutics by MS Characterizing Biotherapeutic Protein 3D Structures by Electrospray Ion-Mobility Mass Spectrometry: Biological Significance and Comparison with X-ray Crystallography and NMR Measurements Location: Room 155 MOD pm 4:10 p.m.

POSTERS Code NumberProteins, General Evaluation of a Sheathless nanoSpray CE-MS Interface for the Analysis of Proteins MP02 055MS of Glycoprotein Determination of N-Glycosylation Sites and Site Heterogeneity in the Extracellular Region of CD44s MP06 120Quantitative Proteomics Absolute Quantification of the Proteome of Chlamydia Trachomatis Using Two-Dimensional Reverse Phase Liquid Chromatography and MSE MP07 171MetabolomicsEvaluation of Analytical, Experimental and Biological Variability in a UPLC-MS Liver metabolic Profiling Study MP14 326Metabolomic Study of Adonifoline, a Pyrrolizidine Alkaloid, Induced Hepatotoxicity in Rats by UPLC/oaTOF MSE MP14 341LC/MS Optimization of Ionization Efficiency and Signal-to-Noise Ratio in LC-MS Analysis of Biological Macromolecules MP16 401Drug BiotransformationSites of Metabolic Substitution: Definitive Metabolite Structures Deduced Using Ion Mobility and Molecular Modeling MP17 416Drug Metabolism, Quantitation Comparison of Accurate Mass and Nominal Mass MS/MS for the Simultaneous Acquisition of Qualitative and Quantitative Data in DMPK Studies MP19 455Environmental Analysis, General GC/LC-MS/MSMS: What Else, in Water Sub-ppt Level of Small Molecules Monitoring? MP20 464Imaging MS, Method DevelopmentAdvantages of Improved MS Resolution and Ion-Mobility Resolution for Lipid Analysis in MALDI Imaging MP25 540In-Situ Tissue Tryptic Digestion to Facilitate Peptide Analysis Using MALDI-MS Techniques to Investigate Protein induction in Tumour Vascular Targeted Strategies MP25 555Direct Ionization Applications Rapid Identification of Sibutramine and Other Adulterants in Herbal Slimming Products Using the Atmospheric Solids Analysis Probe and MS Detection MP26 568Ionization Mechanisms Investigation of the Impact of the Experimetal Parameters on SFC API MS Signal Intensity MP27 580

End the day at Waters Hospitality Suite.Salt Palace Convention Center, 251 DEF, 8:00 p.m.–11:00 p.m.

TUESDAY, MAY 25Start the day at Waters Booth #83 Salt Palace Convention Center, 9:00 a.m. – 5:00 p.m.

POSTERS Code NumberProteins, Non-Covalent Interactions Structural Studies on Bacterial Replisome Protein Complexes Using Electrospray Ionization Mass Spectrometry TP03 061Metals in Medicine: Drug Isomer Separation and Sequence-Specific Metallation of Peptides Using CID, ETD and Ion Mobility-MS TP03 092MS of Glycoprotein II Analysis of N-linked Glycans from Rat Plasma TP06 147Natural Products Identification and Characterization of Steroidal Saponins from Paris Polyphylla var. Yunnanensis by UPLC/oa-TOF MSE

TP13 328Clinical Chemistry II Detection of Impaired Lung Function/Infection in Critical Care and Respiratory Medicine Using Gas Chromatography Time-Of-Flight Mass Spectrometry (GC-TOF) TP15 360Metabolomics II Rapid Metabolomic Profiling of Biological Fluids Using Atmospheric Sample Analysis Probe for Disease State Monitoring TP16 384The Use of an Integrated MicroFluidic LC Device and OA-TOF MS for Metabolomics Studies TP16 383A Novel HILIC LC-MS Method for the Detection and Quantification of Polar Cellular Metabolites TP16 396Small Molecule Quantitation II Simultaneous Determination of Twelve Water-Soluble Vitamin Compounds in Fortified Infant Formula by UPLC-ESI-MS/MS TP17 414Improving Quantitative Analysis of Water-Soluble Vitamins in Cell Culture Media by a LC-MS (MRM) Method TP17 415Nano LC/MS Development of an Intergrated Microscale Ceramic Separation Device to Address Limited Sample Volumes in Bioanalysis TP18 431Drug Biotransformation II Use of High-Resolution QTOF with Enhanced Ion Mobility Capabilities for Facile Identification of Metabolites Using UPLC-IMS-MSE TP19 461The Identification of Novel Phase II Diconjugate Metabolites of Acetaminophen in Urine TP19 463Metabolite ProfilingSimultaneous Lipid Profiling and Lipid Marker Characteriza-tion in Fish Eggs by UPLC/TOF MS Coupled with Multi Variant Statistical Analysis TP20 488MALDI Tandem MS Sequence Analysis of Silencing RNA Oligonucleotides by MALDI QTof TP26 596Ion Sources, APCI/APPI Enhanced APCI on a Novel Ion Source Design TP27 602

End the day at Waters Hospitality Suite.Salt Palace Convention Center, 251 DEF, 8:00 p.m.–11:00 p.m.

W EDNESDAY, MAY 26Start the day at Waters Booth #83 Salt Palace Convention Center, 9:00 a.m. – 5:00 p.m.

ORALS Code TimeLC/MS Strategies for Metabolomics in Drug Discovery HILIC-UPLC-MS for the Metabolic Profiling of Biofluids: Application to Toxicological Studies Location: Hall 2 WOE am 9:30 a.m.MS of Glycoproteins Development of a Hyphenated Ion Mobility – Mass Spectrometry Technique for the Characterization of Glycosylated Peptides Location: Room 155 WOD pm 2:50 p.m.LC/MS Methods for Reactive Xenobiotic Metabolites Characterization of Stereo Conformation of the Reactive Metabolites of the Chlorogenic Acid by UPLC/Ion Mobility/TOF MS Location: Hall 2 WOE pm 3:10 p.m.MS of Pharmaceuticals and Personal Care Products in Water Analysis of Steroids in Manufacturing Plant Waste Effluent by On-Line SPE/UPLC/MS/MS Location: Hall 3 WOF pm 3:10 p.m.

POSTERS Code NumberProtein Conformation, Hydrogen/Deuterium Exchange (HDX)Development of an HXMS Workflow and Its Application to Epitope Mapping W P03 072Investigating Conformational Changes in Oxidized Interferon Alpha-2b by Hydrogen/Deuterium Exchange Mass Spectrometry W P03 084Proteomics, Plasma A Combined Proteomic and Lipidomic approach for Biomarker Discovery of Obstetric Disorders in Individual Patient Plasma During the First Trimester W P05 107Peptides, Quantitation Methods Analytical Challenges in the Development of a Quantitative SPE/LC/MS/MS Assay for Amyloid Beta Peptides in Cerebrospinal Fluid W P08 165Investigating Ion Mobility Coupled with Time-of-Flight Mass Spectrometry and Liquid Chromatography for the Parallel Sequencing of Labelled Isobaric Peptides W P08 180Proteomics, Systems Biology (Non Gel Based) LC/MSE Label-Free Quantitative Proteomic Analysis of Puri-fied Invasive Versus Non-Invasive Plasmodium Falciparum Merozoites in Support of Malaria Vaccine Development W P13 278Metabolomics III Improving the Performance of AccQ•Tag Amino Acid Quantitation in Biological Samples by UPLC-ESI-MS/MS using the Xevo TQ Mass Spectrometer W P16 357

T HURSDAY, MAY 27Start the day at Waters Booth #83 Salt Palace Convention Center, 9:00 a.m. – 3:30 p.m.

ORALS Code TimeElectron and Photon-Based Ion Activation/Dissociation-PD, ECD, ETD, EDD Travelling Wave Ion Mobility Mass Spectrometry of Electron Transfer Dissociation Products of Phosphopeptides: Evidence of Conformational Memory? Location: Ballroom HJ ThOA am 9:10 a.m.Recent Developments in Ion Mobility MS Gas-Phase Structural Biology: Measuring and Interpreting Collision Cross Sections Location: Ballroom BDF ThOC am 9:30 a.m.Metabolomics: Bioinformatics and Metabolite Identification Identification of Unknown Metabolites by Accurate Mass GC-TOF MS – Based Metabolomics Location: Room 155 ThOD am 8:50 a.m.A Rigorous Probabilistic Approach to the Modeling of LC-MS Metabolomic Data Location: Room 155 ThOD am 9:10 a.m.Dried Blood Spot Analysis Implementation of a Microfluidic LC Device for Dried Blood Spot Analysis – Driving Down the Limit of Detection Location: Hall 3 ThOF am 8:30 a.m.Implementation of a Microfluidic LC Device for Dried Blood Spot Analysis – Driving Down the Limit of Detection Location: Hall 3 ThOF am 9:10 a.m.Laser/Surface Desorption Techniques for ADME MALDI Imaging of Distribution of Xanthohumol and Its Metabolites in Rat Tissues Location: Hall 3 ThOF pm 3:50 p.m.

POSTERS Code NumberBioinformatics IV ISOQUANT – A Java-Based Tool for MySQL-Database Export and Integrated Evaluation of Data Independent (LC/MSE) Label-Free Quantitative Proteomics Data ThP01 005Fragment Ion Repositories and Quantitative Protein Identifications ThP01 014Proteins, Recombinant MS Analysis Reveals Differences in a Humanized mAb Protein Drug (Trastuzamab) and a Biosimilar Version ThP02 026Analysis of N-linked Glycans from Recombinant and Human Plasma Derived Coagulation Factor IX Using HILIC LC/FLR/QTof MS ThP02 032Unrevealing Protein Modifications via Top-Down Fragmenta-tion and Ion Mobility Time-of-Flight Mass Spectrometry ThP02 038Comparison of Detector Technologies for LC/QTof MSE Biotherapeutic Protein Peptide Mapping Studies ThP02 040

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POSTERS Code NumberMetabolite Profiling II A Systematic Approach to Targeted Analysis of Carotenoids in the Skin of False Percula Anemone Fish Using LC/MS W P19 437Agriculture Comparative Assessment of ToF Profiling and Tandem Quadrupole Mass Spectrometric Screening of Pesticides in a Vegetable Matrix W P21 475GC/MS Developments and Applications The Application of APGC TOF MS in the Analysis of Archeological Biomarkers Associated with Bitumens in Egyptian Mummies W P25 547Imaging MS, Biomolecules MALDI Imaging of Sub-20 Micron Lipid Distribution in Tissue Using Lasers Operating Between 1 kHz and 10 kHz W P26 565Ion Mobility II Protein Complexes as Ion Mobility Standards: Strategies for Reducing their Uncertainties and Benefits for Gas-Phase Structural Biology W P30 642Collision Cross-Section Determination of Isomeric Carotenoids Using Electrospray Ion Mobility Time-of-Flight Mass Spectrometry W P30 650Folding Analysis of Carbonic Anhydrase2 Using Ion Mobility and Subsequent Collision-Induced Dissociation W P30 653Higher Resolving Power and Ion Mobility Significantly Reduces the Effects of Over Lapping Ion Clusters in “Systems” Samples W P30 655Ion Mobility Analyses of Peptide Ions Produced By CID and ETD Fragmentation W P30 659Separation of Fragment Ions of Lipids in Gaucher Disease Tissues Using High/Low Energy Function Switching MALDI IMS Imaging W P30 660Investigating Aniline Isomer Separation Utilizing Travelling Wave Ion Mobility and Polarizable Drift Gases W P30 661Cage Flight! Ion Mobility-Mass Spectrometry of Self-assembling 3-D Architectures W P30 664

End the day at Waters Hospitality Suite.Salt Palace Convention Center, 251 DEF, 8:00 p.m.–11:00 p.m.

POSTERS Code NumberProteomics, New Approaches III Investigating Chromatographic and Mass Spectrometric Reso-lution and Accuracy on Relative and Absolute Quantification of Proteins Associated with Cellular Hypoxia ThP05 107Characterization of a Bacterial Proteome by Means of Ion Mobility Mass Spectrometry-Based Proteomics ThP05 126Carbohydrates II Profiling Fetuin Glycans Composition by HILIC-LC/MSE ThP13 320Small Molecule Analysis Rapidly Monitoring Chemical Reactions and Identifying Products with Thermal Desorption/MS to Improve Synthesis Lab Workflow and Productivity ThP16 393LC-MS Sample Preparation II Addressing the Issues of Matrix Resolution and Measurement in Bioanalytical Assays ThP18 456Environmental Analysis, Hydrocarbons and DOM Development of Hydrophilic Interaction Chromatographic-Mass Spectrometry Method for the Analysis of the Acid Fraction of Oilsands Processing Water ThP20 481Hydrocarbon & Petro, Biofuels & Geochemistry Evaluation of APGC TOF MS for Biomarker Analysis in Petroleum Geochemistry ThP21 502Computer Analysis Achieving Regulatory Compliant Biotherapeutic LC/QTof-MS Analyses within a Prototype Data Acquisition, Processing, and Bioinformatics Environment ThP23 534A Unified Algorithm for Deconvoluting Electrospray Ionization Mass Spectral Data ThP23 536Imaging MS, Small Molecules Successful Application for Distribution Image of Chloroquine in Ocular Tissue of Pigmented Rat using MALDI-Imaging Quadrupole Time-of-Flight Mass Spectrometry ThP25 588Ion Molecule Reactions A Radical Approach to Ion Conformation Determination: Electron Transfer Dissociation, Ion Mobility and Molecular Modeling ThP26 614Instrumentation, New Concepts II A New Conjoined RF Ion Guide for Enhanced Ion Transmission ThP27 634Instrumentation Quadrupoles and Traps A New Linear Quadrupole Ion Trap with Axial Ejection ThP28 646ScanWave-Enabled MS3 Analysis on a Tandem Quadrupole Mass Spectrometer ThP28 651

N E W F R O M W A T E R S

Xevo™ TQ-S This tandem quadrupole mass spectrometer features a revolutionary new off-axis ion-source technology, known as StepWave.™ This technology enables you toquantify and confirm trace components at the low-est possible levels in the most complex of samples. It also features ScanWave™ technology – for rapid MRM acquisition for targeted quantification – and RADAR™ – for collection of highly specific quantita-tive data for target compounds and visualization of all other components in sample matrices.

Xevo G2 QTofThis next-generation exact mass MS/MS benchtop system maintains the integrated workflow of Engi-neered SimplicityTM and incorporates the ground-breaking QuanTofTM technology of our SYNAPTTM G2 System. Xevo G2 QTof devliers conventional MS and MS/MS methods of data acquisition. It has the unique ability to perform UPLC®/MSE – a simple, patented method of unbiased data acquisition that comprehensively catalogs complex samples in a single analysis.

nanoACQUITY UPLC® System with Hydrogen Deuterium Exchange (HDX) Technology For pharmaceutical scientists who require protein conformation data, this is the only holistically designed system that provides UltraPerformance LC, high-resolution MS, sample prep automation, and timely data analysis, to make critical decisions about drug binding, product stability, and protein-protein interactions.

ACQUITY UPLC® H-Class SystemThe UPLC System for HPLC users. If your laboratory’s focus is running routine analyses or developing methods, you can now access the performance and productivity of sub-2-µm particle UltraPerformance LC.®

TRIZAIC UPLC® System with nanoTile™ TechnologyThe combination of novel nanofluidic separation technology with Waters chemistries, unique solvent delivery, and comprehensive data management in one easy step lets you spend less time on setup and more time on your science.

Ostro™ Enhanced Protein Precipitation (EPPT) ProductsA novel cleanup approach of plasma samples for LC/MS/MS analysis with no method development required. The device provides consistent high extraction recoveries of acids, bases, and neutrals in much cleaner extracts than protein precipitation (PPT). Ostro EPPT products increase method robustness, sensitivity, and instrument uptime with a generic PPT method.

Waters Booth #83Salt Palace Convention CenterMay 24 – 26 9:00 a.m. – 5:00 p.m. May 279:00 a.m. – 3:30 p.m.

Waters Hospitality Suite Salt Palace Convention Center, 251 DEFMay 24 – 26 8:00 p.m. – 11:00 p.m.

Waters Poster PresentationsSalt Palace Convention CenterMay 24 – 2710:30 a.m. – 2:30 p.m.

Waters Oral PresentationsSalt Palace Convention CenterMay 24 – 27Locations and times vary.