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(E)-1-[(4S,5R)-4-methyl-5-phenyl-2-sulfanylidene-1,3-oxazolidin-3-yl]-3-phenyl-prop-2-en-1-one
SpectraBase Compound ID 4jRYcpkceI5
InChI InChI=1S/C19H17NO2S/c1-14-18(16-10-6-3-7-11-16)22-19(23)20(14)17(21)13-12-15-8-4-2-5-9-15/h2-14,18H,1H3/b13-12+/t14-,18-/m0/s1
InChIKey ITSRFYCRBNXLFW-RMCBBKKWSA-N
Mol Weight 323.41 g/mol
Molecular Formula C19H17NO2S
Exact Mass 323.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPulhxRf9eJ
Name (E)-1-[(4S,5R)-4-methyl-5-phenyl-2-sulfanylidene-1,3-oxazolidin-3-yl]-3-phenyl-prop-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H17NO2S
InChI InChI=1S/C19H17NO2S/c1-14-18(16-10-6-3-7-11-16)22-19(23)20(14)17(21)13-12-15-8-4-2-5-9-15/h2-14,18H,1H3/b13-12+/t14-,18-/m0/s1
InChIKey ITSRFYCRBNXLFW-RMCBBKKWSA-N
Molecular Weight 323.410 g/mol
SMILES C1(N([C@]([C@](O1)(c1ccccc1)[H])(C)[H])C(\C=C\c1ccccc1)=O)=S
SPLASH splash10-0a4i-0900000000-4465d957c0a59c0c44ac
Source of Spectrum QE-12-3901-5
Synonyms (E)-1-[(4S,5R)-4-methyl-5-phenyl-2-sulfanylidene-3-oxazolidinyl]-3-phenyl-2-propen-1-one (E)-1-[(4S,5R)-4-methyl-5-phenyl-2-thioxo-oxazolidin-3-yl]-3-phenyl-prop-2-en-1-one
Wiley ID 1586921