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2,2-Dimethyl-5-[[4-oxo-3-(2,3,4,5,6-pentafluorophenyl)-5-[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]-2-thioxo-imidazolidin-1-yl]methyl]oxazolidin-4-one
SpectraBase Compound ID BY7iAHUnLMK
InChI InChI=1S/C18H18F5N3O3S/c1-6(2)13-16(28)26(14-11(22)9(20)8(19)10(21)12(14)23)17(30)25(13)5-7-15(27)24-18(3,4)29-7/h6-7,13H,5H2,1-4H3,(H,24,27)/i1D3,2D3,6D
InChIKey UDEXVXVKSMVTKP-NWOXSKRJSA-N
Mol Weight 458.45 g/mol
Molecular Formula C18H11D7F5N3O3S
Exact Mass 458.142841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpHHOhcvXAW
Name 2,2-Dimethyl-5-[[4-oxo-3-(2,3,4,5,6-pentafluorophenyl)-5-[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]-2-thioxo-imidazolidin-1-yl]methyl]oxazolidin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11D7F5N3O3S
InChI InChI=1S/C18H18F5N3O3S/c1-6(2)13-16(28)26(14-11(22)9(20)8(19)10(21)12(14)23)17(30)25(13)5-7-15(27)24-18(3,4)29-7/h6-7,13H,5H2,1-4H3,(H,24,27)/i1D3,2D3,6D
InChIKey UDEXVXVKSMVTKP-NWOXSKRJSA-N
Literature Reference DOI 10.1002/rcm.1116
Molecular Weight 458.455 g/mol
SMILES N1C(OC(C1=O)CN1C(C(N(c2c(c(c(c(c2F)F)F)F)F)C1=S)=O)C(C([D])([D])[D])(C([D])([D])[D])[D])(C)C
SPLASH splash10-000i-0000900000-f75c6d28b749e44b8ba9
Source of Spectrum RCM-17-1863-Fig5(a)
Synonyms 2,2-Dimethyl-5-((4-oxo-3-(perfluorophenyl)-5-(propan-2-yl-d7)-2-thioxoimidazolidin-1-yl)methyl)oxazolidin-4-one
Wiley ID 1819885