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S-ETHYLTHIOCARBONYL-PARA-TOLUENE
SpectraBase Compound ID Hstdn0Q558r
InChI InChI=1S/C10H12OS/c1-3-12-10(11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3
InChIKey JJLWSRBOLXFWER-UHFFFAOYSA-N
Mol Weight 180.26 g/mol
Molecular Formula C10H12OS
Exact Mass 180.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fg9obqvRpx
Name 4-Methylbenzenecarbothioic acid S-ethyl ester
CAS Registry Number 28145-60-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12OS
InChI InChI=1S/C10H12OS/c1-3-12-10(11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3
InChIKey JJLWSRBOLXFWER-UHFFFAOYSA-N
Molecular Weight 180.265 g/mol
SMILES C(c1ccc(cc1)C)(=O)SCC
SPLASH splash10-0a4i-4900000000-9918556ce6269f0e39cd
Source of Spectrum O-3-2624-0
Synonyms 4-Methylthiobenzoic acid S-ethyl ester S-ethyl 4-methylbenzenecarbothioate
Wiley ID 1176041