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2-Thiophenecarboxylic acid, 3-amino-4-(aminophenylmethylene)-4,5-dihydro-5-thioxo-, ethyl ester
SpectraBase Compound ID X1d7HujltW
InChI InChI=1S/C14H14N2O2S2/c1-2-18-13(17)12-11(16)9(14(19)20-12)10(15)8-6-4-3-5-7-8/h3-7H,2,15-16H2,1H3/b10-9-
InChIKey PCVARUCUKKHVOY-KTKRTIGZSA-N
Mol Weight 306.4 g/mol
Molecular Formula C14H14N2O2S2
Exact Mass 306.04967 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIuCksNywiF
Name 2-Thiophenecarboxylic acid, 3-amino-4-(aminophenylmethylene)-4,5-dihydro-5-thioxo-, ethyl ester
CAS Registry Number 126938-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2S2
InChI InChI=1S/C14H14N2O2S2/c1-2-18-13(17)12-11(16)9(14(19)20-12)10(15)8-6-4-3-5-7-8/h3-7H,2,15-16H2,1H3/b10-9-
InChIKey PCVARUCUKKHVOY-KTKRTIGZSA-N
Molecular Weight 306.398 g/mol
SMILES NC=1\C(=C\(c2ccccc2)N)C(SC1C(=O)OCC)=S
SPLASH splash10-0zgj-6879000000-541d067249663a39d0f2
Source of Spectrum B-42-1305-5
Synonyms Ethyl (4Z)-3-amino-4-[amino(phenyl)methylene]-5-thioxo-4,5-dihydro-2-thiophenecarboxylate Ethyl 3-amino-4-(..alpha.-aminobenzylidene)-5-thioxo-4,5-dihydrothiophen-2-carboxylate
Wiley ID 1307782