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

*Links on SpectraBase are not permalinks.
THIOBENZOIC ACID, S-BENZYL ESTER
SpectraBase Compound ID AmJw7hwUEA6
InChI InChI=1S/C14H12OS/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2
InChIKey IXTYVGVNWHFZBK-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C14H12OS
Exact Mass 228.060886 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 9WDF2j0XhBG
Name S-Benzyl thiobenzoate
Alternate Name(s) benzenecarbothioic acid S-(phenylmethyl) ester S-(phenylmethyl) benzenecarbothioate S-benzyl benzenecarbothioate thiobenzoic acid S-benzyl ester
CAS Registry Number 13402-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12OS
InChI InChI=1S/C14H12OS/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2
InChIKey IXTYVGVNWHFZBK-UHFFFAOYSA-N
Molecular Weight 228.309 g/mol
SMILES C(SCc1ccccc1)(=O)c1ccccc1
SPLASH splash10-0a4i-4910000000-32c65695b1a28a34bbfc
Source of Spectrum J-59-5827-1
Wiley ID 1229861