2024
High-Resolution Mass Spectrometry for Human Exposomics: Expanding Chemical Space Coverage
Lai Y, Koelmel J, Walker D, Price E, Papazian S, Manz K, Castilla-Fernández D, Bowden J, Nikiforov V, David A, Bessonneau V, Amer B, Seethapathy S, Hu X, Lin E, Jbebli A, McNeil B, Barupal D, Cerasa M, Xie H, Kalia V, Nandakumar R, Singh R, Tian Z, Gao P, Zhao Y, Froment J, Rostkowski P, Dubey S, Coufalíková K, Seličová H, Hecht H, Liu S, Udhani H, Restituito S, Tchou-Wong K, Lu K, Martin J, Warth B, Pollitt K, Klánová J, Fiehn O, Metz T, Pennell K, Jones D, Miller G. High-Resolution Mass Spectrometry for Human Exposomics: Expanding Chemical Space Coverage. Environmental Science And Technology 2024, 58: 12784-12822. PMID: 38984754, PMCID: PMC11271014, DOI: 10.1021/acs.est.4c01156.Peer-Reviewed Original ResearchHigh-resolution mass spectrometryChemical spaceCoverage of chemical spaceMass spectrometryAccurate mass measurementsChemical space coverageNon-target approachHuman exposomeAnalytical workflowMass measurementsDisease outcomeGenetic driversSpectrometryHarmonized workflowMulti-omics integrationRetrospective validationCare providersChemistsMetabolomicsSpace coverageBiomoleculesHypothesis-drivenDisease
2017
Expanding Lipidome Coverage Using LC-MS/MS Data-Dependent Acquisition with Automated Exclusion List Generation
Koelmel J, Kroeger N, Gill E, Ulmer C, Bowden J, Patterson R, Yost R, Garrett T. Expanding Lipidome Coverage Using LC-MS/MS Data-Dependent Acquisition with Automated Exclusion List Generation. Journal Of The American Society For Mass Spectrometry 2017, 28: 908-917. PMID: 28265968, PMCID: PMC5408749, DOI: 10.1007/s13361-017-1608-0.Peer-Reviewed Original ResearchHR-MS/MS spectraUltra-high performance liquid chromatographyResolution tandem mass spectrometryHigh-resolution tandem mass spectrometryPositive ion modeField of lipidomicsTandem mass spectrometryMS/MSIon modePerformance liquid chromatographyMS spectraLC-MS/MS dataMass spectrometryChromatographic elutionSequential injectionLiquid chromatographyTrace speciesMS dataUnique precursorDependent acquisitionBiomoleculesBiological systemsNumber of precursors