机译:Supporting non-target identification by adding hydrogen deuterium exchange MS/MS capabilities to MetFrag
Leibniz Inst Plant Biochem, Dept Stress & Dev Biol, Weinberg 3, D-06120 Halle, Germany;
Univ Luxembourg, LCSB, 6 Ave Swing, L-4367 Belvaux, Luxembourg;
Eawag Swiss Fed Inst Aquat Sci & Technol, Dept Environm Chem, Uberlandstr 133, CH-8600 Dubendorf, SwitzerlandUS EPA, NCCT, Res Triangle Pk, NC 27711 USAUFZ Helmholtz Ctr Environm Res, Permoserstr 15, D-04318 Leipzig, Germany;
Compound identification; In silico fragmentation; Hydrogen deuterium exchange; High-resolution mass spectrometry; Structure elucidation; Metabolomics;