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A-Toluenethiol

View entire compound with spectra: 10 NMR, 9 FTIR, 12 MS (GC), and 2 Near IR

A-Toluenethiol
SpectraBase Compound ID 5ZgH7p1M5K3
InChI InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey UENWRTRMUIOCKN-UHFFFAOYSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H8S
Exact Mass 124.034671 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JQssA2ciw15
Name Benzyl mercaptan
Source of Sample Aldrich
Catalog Number B25401
CAS Registry Number 100-53-8
Classification Aromatic mercaptans and sulfides
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8S
InChI InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey UENWRTRMUIOCKN-UHFFFAOYSA-N
Purity 99%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Toluenethiol; alpha-Tolyl mercaptan
Technique Neat
Wiley ID SIAL_FTIR_1_8857