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S-methyl 3-methylbenzenecarbothioate
SpectraBase Compound ID 2Fw3nima3be
InChI InChI=1S/C9H10OS/c1-7-4-3-5-8(6-7)9(10)11-2/h3-6H,1-2H3
InChIKey FHLWVPARCGQJEI-UHFFFAOYSA-N
Mol Weight 166.24 g/mol
Molecular Formula C9H10OS
Exact Mass 166.045236 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjIBcC0rdq5
Name S-methyl 3-methylbenzenecarbothioate
Alternate Name(s) 3-Methylbenzenecarbothioic acid S-methyl ester
CAS Registry Number 28145-55-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10OS
InChI InChI=1S/C9H10OS/c1-7-4-3-5-8(6-7)9(10)11-2/h3-6H,1-2H3
InChIKey FHLWVPARCGQJEI-UHFFFAOYSA-N
Molecular Weight 166.238 g/mol
SMILES C(c1cc(C)ccc1)(=O)SC
SPLASH splash10-0a6r-6900000000-b93626b29a05600ed2f1
Source of Spectrum O-3-2623-0
Wiley ID 1162108