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acetic acid, (benzoylthio)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

acetic acid, (benzoylthio)-
SpectraBase Compound ID EvYce5xZzqt
InChI InChI=1S/C9H8O3S/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)
InChIKey VJRWULUDVUWCCQ-UHFFFAOYSA-N
Mol Weight 196.22 g/mol
Molecular Formula C9H8O3S
Exact Mass 196.019415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5DFilthInU
Name (benzoylsulfanyl)acetic acid
Alternate Name(s) 2-(benzoylthio)acetic acid 2-(Phenylcarbonylsulfanyl)ethanoic acid 2-Benzoylsulfanylacetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O3S
InChI InChI=1S/C9H8O3S/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)
InChIKey VJRWULUDVUWCCQ-UHFFFAOYSA-N
Molecular Weight 196.220 g/mol
SMILES OC(CSC(=O)c1ccccc1)=O
SPLASH splash10-0a6r-9800000000-09f3d30f546798ab9739
Wiley ID 1448751