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2-butenoic acid, 2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)amino]-4-oxo-4-phenyl-, (2Z)-
SpectraBase Compound ID 1frz7cCtJBF
InChI InChI=1S/C18H14N2O3S/c19-10-13-12-7-4-8-16(12)24-17(13)20-14(18(22)23)9-15(21)11-5-2-1-3-6-11/h1-3,5-6,9,20H,4,7-8H2,(H,22,23)/b14-9-
InChIKey JLRPVPGGZVADJX-ZROIWOOFSA-N
Mol Weight 338.38 g/mol
Molecular Formula C18H14N2O3S
Exact Mass 338.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xul8c6Jzn0
Name (Z)-2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-keto-4-phenyl-but-2-enoic acid
Alternate Name(s) (Z)-2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxidanylidene-4-phenyl-but-2-enoic acid (Z)-2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxo-4-phenyl-2-butenoic acid (Z)-2-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxo-4-phenyl-but-2-enoic acid
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Formula C18H14N2O3S
InChI InChI=1S/C18H14N2O3S/c19-10-13-12-7-4-8-16(12)24-17(13)20-14(18(22)23)9-15(21)11-5-2-1-3-6-11/h1-3,5-6,9,20H,4,7-8H2,(H,22,23)/b14-9-
InChIKey JLRPVPGGZVADJX-ZROIWOOFSA-N
Molecular Weight 338.381 g/mol
SMILES N(\C(C(=O)O)=C/C(=O)c1ccccc1)c1c(c2CCCc2s1)C#N
SPLASH splash10-0a6u-5941000000-7ae5a145058d7747fa83
Wiley ID 1453025