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BENZENECARBOTHIOIC-ACID-METHYLESTER
SpectraBase Compound ID 3j5TCMUflh
InChI InChI=1S/C8H8OS/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RQVWTMCUTHKGCM-UHFFFAOYSA-N
Mol Weight 152.21 g/mol
Molecular Formula C8H8OS
Exact Mass 152.029586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41UFoRVaGL
Name Benzenecarbothioic acid, S-methyl ester
CAS Registry Number 5925-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8OS
InChI InChI=1S/C8H8OS/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RQVWTMCUTHKGCM-UHFFFAOYSA-N
Molecular Weight 152.211 g/mol
SMILES C(=O)(c1ccccc1)SC
SPLASH splash10-05fs-9500000000-41df872b20553166098e
Source of Spectrum AH-135-81-1
Synonyms benzenecarbothioic acid S-methyl ester Benzoic acid, thio-, S-methyl ester S-ethyl benzothioate S-Methyl benzenecarbothioate S-Methyl thiobenzoate Thiobenzoic acid S-methyl ester EINECS 227-656-2
Wiley ID 1576335