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o-Toluenethiol
SpectraBase Compound ID HNBK5CC4VrO
InChI InChI=1S/C7H8S/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3
InChIKey LXUNZSDDXMPKLP-UHFFFAOYSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H8S
Exact Mass 124.034671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GaYhoG6WWf
Name Benzenethiol, 2-methyl-
CAS Registry Number 137-06-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8S
InChI InChI=1S/C7H8S/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3
InChIKey LXUNZSDDXMPKLP-UHFFFAOYSA-N
Molecular Weight 124.201 g/mol
SMILES Sc1c(C)cccc1
SPLASH splash10-00bd-9100000000-956cd69ec853e46844d9
Source of Spectrum NW-2563-0-0
Synonyms 2-Methylbenzenethiol 2-Methylphenylthiol 2-Methylthiophenol 2-Thiocresol 2-Toluenethiol o-Mercaptotoluene o-Methylbenzenethiol o-Methylthiophenol o-Thiocresol o-Toluenethiol o-Tolyl mercaptan Toluene, 2-mercapto- Toluene-2-thiol Toluenethiol, o- Tolylmercaptan, o- Tolylthiol, o- BRN 0774068 EINECS 205-276-8 FEMA NO. 3240 HSDB 2022 NSC 80655 USAF EK-2676
Wiley ID 1128820