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Benzo[b]thiophene-3-acetic acid, 4-methyl-.alpha.-(phenylmethylene)-
SpectraBase Compound ID 5bU6xOsbBpv
InChI InChI=1S/C18H14O2S/c1-12-6-5-9-16-17(12)15(11-21-16)14(18(19)20)10-13-7-3-2-4-8-13/h2-11H,1H3,(H,19,20)/b14-10-
InChIKey WNNTWVAPBYHRMA-UVTDQMKNSA-N
Mol Weight 294.37 g/mol
Molecular Formula C18H14O2S
Exact Mass 294.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DWQBKHA1kd
Name Benzo[b]thiophene-3-acetic acid, 4-methyl-.alpha.-(phenylmethylene)-
CAS Registry Number 83821-48-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O2S
InChI InChI=1S/C18H14O2S/c1-12-6-5-9-16-17(12)15(11-21-16)14(18(19)20)10-13-7-3-2-4-8-13/h2-11H,1H3,(H,19,20)/b14-10-
InChIKey WNNTWVAPBYHRMA-UVTDQMKNSA-N
Molecular Weight 294.368 g/mol
SMILES OC(\C(c1csc2c1c(ccc2)C)=C/c1ccccc1)=O
SPLASH splash10-00dm-0690000000-1b75f8aa33546e27c49f
Source of Spectrum Y-19-862-0
Synonyms (2Z)-2-(4-methyl-1-benzothien-3-yl)-3-phenyl-2-propenoic acid 2-(4-Methylbenzo[b]thiophen-3-yl)-3-phenylpropenoic acid
Wiley ID 1297347