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(2E)-2-[(3-chloroanilino)methylidene]-3-oxobutanoic acid ethyl ester
SpectraBase Compound ID 1pCkTmRBsiR
InChI InChI=1S/C13H14ClNO3/c1-3-18-13(17)12(9(2)16)8-15-11-6-4-5-10(14)7-11/h4-8,15H,3H2,1-2H3/b12-8+
InChIKey QCPAMNURMFNXIL-XYOKQWHBSA-N
Mol Weight 267.71 g/mol
Molecular Formula C13H14ClNO3
Exact Mass 267.066221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BsETEMFqpl
Name (2E)-2-[(3-chloroanilino)methylidene]-3-oxobutanoic acid ethyl ester
Alternate Name(s) (E)-2-acetyl-3-(3-chloroanilino)acrylic acid ethyl ester Ethyl (2E)-2-acetyl-3-(3-chloroanilino)-2-propenoate Ethyl (2E)-2-[(3-chloroanilino)methylene]-3-oxo-butanoate Ethyl (2E)-2-[(3-chloroanilino)methylidene]-3-oxobutanoate Ethyl (2E)-2-[[(3-chlorophenyl)amino]methylidene]-3-oxidanylidene-butanoate
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Formula C13H14ClNO3
InChI InChI=1S/C13H14ClNO3/c1-3-18-13(17)12(9(2)16)8-15-11-6-4-5-10(14)7-11/h4-8,15H,3H2,1-2H3/b12-8+
InChIKey QCPAMNURMFNXIL-XYOKQWHBSA-N
Molecular Weight 267.712 g/mol
SMILES N(\C=C\(C(=O)OCC)C(=O)C)c1cc(Cl)ccc1
SPLASH splash10-0006-1930000000-693772421835f208fc9c
Source of Spectrum O-27-123-3
Wiley ID 1271029