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2-Thiophenecarboxylic acid, 4-(aminophenylmethylene)-4,5-dihydro-5-thioxo-, ethyl ester
SpectraBase Compound ID 2ADqBE6QkEC
InChI InChI=1S/C14H13NO2S2/c1-2-17-13(16)11-8-10(14(18)19-11)12(15)9-6-4-3-5-7-9/h3-8H,2,15H2,1H3/b12-10-
InChIKey DAVKVVARYWGXRR-BENRWUELSA-N
Mol Weight 291.38 g/mol
Molecular Formula C14H13NO2S2
Exact Mass 291.038771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2g1cmaumVBY
Name 2-Thiophenecarboxylic acid, 4-(aminophenylmethylene)-4,5-dihydro-5-thioxo-, ethyl ester
CAS Registry Number 126939-09-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO2S2
InChI InChI=1S/C14H13NO2S2/c1-2-17-13(16)11-8-10(14(18)19-11)12(15)9-6-4-3-5-7-9/h3-8H,2,15H2,1H3/b12-10-
InChIKey DAVKVVARYWGXRR-BENRWUELSA-N
Molecular Weight 291.383 g/mol
SMILES N\C(=C/1C(SC(=C1)C(=O)OCC)=S)c1ccccc1
SPLASH splash10-0pb9-2292000000-5ef715973dea745734b2
Source of Spectrum B-42-1305-5
Synonyms Ethyl (4Z)-4-[amino(phenyl)methylene]-5-thioxo-4,5-dihydro-2-thiophenecarboxylate Ethyl 4-(..alpha.-aminobenzylidene)-5-thioxo-4,5-dihydrothiophen-2-carboxylate Ethyl N-[4-(..alpha.-aminobenzylidene)-5-thioxo-4,5-dihydro-2-thienyl]carbamate
Wiley ID 1294408