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thiobenzoic acid S-(phenylthio) ester

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

thiobenzoic acid S-(phenylthio) ester
SpectraBase Compound ID B5XW7PRkcEk
InChI InChI=1S/C13H10OS2/c14-13(11-7-3-1-4-8-11)16-15-12-9-5-2-6-10-12/h1-10H
InChIKey MJPHPNBGKHEOII-UHFFFAOYSA-N
Mol Weight 246.34 g/mol
Molecular Formula C13H10OS2
Exact Mass 246.017307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UfwfWr2DTo
Name benzenecarbothioic acid S-(phenylthio) ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10OS2
InChI InChI=1S/C13H10OS2/c14-13(11-7-3-1-4-8-11)16-15-12-9-5-2-6-10-12/h1-10H
InChIKey MJPHPNBGKHEOII-UHFFFAOYSA-N
Molecular Weight 246.342 g/mol
SMILES C(SSc1ccccc1)(=O)c1ccccc1
SPLASH splash10-0a6r-6900000000-fd69779f6a5be3e88984
Source of Spectrum SO-0-1038-4
Synonyms S-phenylsulfanyl benzenecarbothioate thiobenzoic acid S-(phenylthio) ester
Wiley ID 864432