For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(benzylthio)acetic acid, methyl ester
SpectraBase Compound ID CktQYkAAtsR
InChI InChI=1S/C10H12O2S/c1-12-10(11)8-13-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKey QQDHRVYAGDFBOI-UHFFFAOYSA-N
Mol Weight 196.26 g/mol
Molecular Formula C10H12O2S
Exact Mass 196.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5lSW7zlWSKP
Name Acetic acid, (benzylthio)-, methyl ester
CAS Registry Number 17277-59-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2S
InChI InChI=1S/C10H12O2S/c1-12-10(11)8-13-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKey QQDHRVYAGDFBOI-UHFFFAOYSA-N
Molecular Weight 196.264 g/mol
SMILES c1ccc(cc1)CSCC(=O)OC
SPLASH splash10-006x-9800000000-c9bf24b7726917aa727b
Source of Spectrum O-2-4191-7
Synonyms Acetic acid, [(phenylmethyl)thio]-, methyl ester Methyl (benzylsulfanyl)acetate 2-(benzylthio)acetic acid methyl ester 2-(Phenylmethylthio)acetic acid methyl ester Methyl (benzylthio)acetate Methyl .alpha.-(benzylthio)acetate Methyl 2-(benzylthio)acetate Methyl 2-(phenylmethylsulfanyl)ethanoate Methyl 2-benzylsulfanylacetate Methyl S-benzylthioglycolate
Wiley ID 1192707