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Methyl N-[(4'-chlorophenyl)acetyl]fumarate-amide
SpectraBase Compound ID IafcyXUa8DQ
InChI InChI=1S/C13H12ClNO4/c1-19-13(18)7-6-11(16)15-12(17)8-9-2-4-10(14)5-3-9/h2-7H,8H2,1H3,(H,15,16,17)/b7-6+
InChIKey YUCXUODKRBMXSX-VOTSOKGWSA-N
Mol Weight 281.69 g/mol
Molecular Formula C13H12ClNO4
Exact Mass 281.045486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHJGt2fvBGF
Name Methyl N-[(4'-chlorophenyl)acetyl]fumarate-amide
Alternate Name(s) (E)-4-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-4-oxo-2-butenoic acid methyl ester Methyl (E)-4-[[2-(4-chlorophenyl)acetyl]amino]-4-oxobut-2-enoate Methyl (E)-4-[[2-(4-chlorophenyl)acetyl]amino]-4-oxo-but-2-enoate Methyl (E)-4-[2-(4-chlorophenyl)ethanoylamino]-4-oxidanylidene-but-2-enoate
CAS Registry Number 139097-21-5
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Formula C13H12ClNO4
InChI InChI=1S/C13H12ClNO4/c1-19-13(18)7-6-11(16)15-12(17)8-9-2-4-10(14)5-3-9/h2-7H,8H2,1H3,(H,15,16,17)/b7-6+
InChIKey YUCXUODKRBMXSX-VOTSOKGWSA-N
Molecular Weight 281.695 g/mol
SMILES N(C(=O)Cc1ccc(cc1)Cl)C(\C=C\C(=O)OC)=O
SPLASH splash10-0udi-1920000000-492559a044aa45961531
Source of Spectrum U-1992-796-13
Wiley ID 764275