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(rac)2-Acetylsulfanyl-4,4,4-trifluoro-2-mercaptobutyric acid isobutyl ester
SpectraBase Compound ID DVd2SunrLFa
InChI InChI=1S/C10H15F3O3S/c1-6(2)5-16-9(15)8(17-7(3)14)4-10(11,12)13/h6,8H,4-5H2,1-3H3
InChIKey JGROJAUVOWOMLQ-UHFFFAOYSA-N
Mol Weight 272.28 g/mol
Molecular Formula C10H15F3O3S
Exact Mass 272.0694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73g5TZ3rGkz
Name (rac)2-Acetylsulfanyl-4,4,4-trifluoro-2-mercaptobutyric acid isobutyl ester
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Formula C10H15F3O3S
InChI InChI=1S/C10H15F3O3S/c1-6(2)5-16-9(15)8(17-7(3)14)4-10(11,12)13/h6,8H,4-5H2,1-3H3
InChIKey JGROJAUVOWOMLQ-UHFFFAOYSA-N
Molecular Weight 272.282 g/mol
SMILES C(CC(C(OCC(C)C)=O)SC(=O)C)(F)(F)F
SPLASH splash10-0006-9330000000-c1da48cd0fa44b5c08ab
Source of Spectrum QC-11-2130-9
Synonyms (rac)2-Acetylsulfanyl-4,4,4-trifluoro-butyric acid isobutyl ester 2-(acetylthio)-4,4,4-trifluorobutanoic acid 2-methylpropyl ester 2-Methylpropyl 2-acetylsulfanyl-4,4,4-trifluorobutanoate isobutyl 2-acetylsulfanyl-4,4,4-trifluoro-butanoate 2-Methylpropyl 2-ethanoylsulfanyl-4,4,4-tris(fluoranyl)butanoate
Wiley ID 859909