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4-(4-Methylphenyl)benzo[b](2-methy1thiophene)-6-carboxylic Acid
SpectraBase Compound ID JZQF1t1ZCgV
InChI InChI=1S/C17H14O2S/c1-10-3-5-12(6-4-10)14-8-13(17(18)19)9-16-15(14)7-11(2)20-16/h3-9H,1-2H3,(H,18,19)
InChIKey WNXODDOENUIFGF-UHFFFAOYSA-N
Mol Weight 282.36 g/mol
Molecular Formula C17H14O2S
Exact Mass 282.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CzvhU3mUbIq
Name 4-(4-Methylphenyl)benzo[b](2-methy1thiophene)-6-carboxylic Acid
Alternate Name(s) 2-Methyl-4-(p-tolyl)benzo[b]thiophene-6-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O2S
InChI InChI=1S/C17H14O2S/c1-10-3-5-12(6-4-10)14-8-13(17(18)19)9-16-15(14)7-11(2)20-16/h3-9H,1-2H3,(H,18,19)
InChIKey WNXODDOENUIFGF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19903320320
Molecular Weight 282.357 g/mol
SMILES OC(c1cc(c2c(c1)sc(c2)C)-c1ccc(cc1)C)=O
SPLASH splash10-001i-2190000000-de3e206434141fdaa7a6
Source of Spectrum JF-332-417-E_7b
Wiley ID 1789651