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4-METHYL-PHENYLTHIOLBENZOATE
SpectraBase Compound ID GbLs2QZaxzU
InChI InChI=1S/C14H12OS/c1-11-7-9-13(10-8-11)16-14(15)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey KMGHFAGCHUDSMG-UHFFFAOYSA-N
Mol Weight 228.31 g/mol
Molecular Formula C14H12OS
Exact Mass 228.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rpSgrVKI5m
Name S-(4-tolyl) benzothioate
Comments Less than 3 mono-isotopic peaks
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Formula C14H12OS
InChI InChI=1S/C14H12OS/c1-11-7-9-13(10-8-11)16-14(15)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey KMGHFAGCHUDSMG-UHFFFAOYSA-N
Molecular Weight 228.309 g/mol
SMILES C(Sc1ccc(cc1)C)(=O)c1ccccc1
SPLASH splash10-0a4i-0910000000-d19763b58893cac4cb5a
Source of Spectrum F-67-7855-d
Synonyms benzenecarbothioic acid S-(4-methylphenyl) ester S-(4-methylphenyl) benzenecarbothioate S-(p-tolyl) benzenecarbothioate thiobenzoic acid S-(p-tolyl) ester
Wiley ID 1691273