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2-[(4-benzoylanilino)methylene]malonic acid diethyl ester
SpectraBase Compound ID FmmHAj9HIVW
InChI InChI=1S/C21H21NO5/c1-3-26-20(24)18(21(25)27-4-2)14-22-17-12-10-16(11-13-17)19(23)15-8-6-5-7-9-15/h5-14,22H,3-4H2,1-2H3
InChIKey KPVOCGPABUAUPB-UHFFFAOYSA-N
Mol Weight 367.4 g/mol
Molecular Formula C21H21NO5
Exact Mass 367.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ef0n5FAvb5E
Name 2-[(4-benzoylanilino)methylene]malonic acid diethyl ester
Alternate Name(s) 2-[(4-benzoylanilino)methylidene]propanedioic acid diethyl ester Diethyl 2-[(4-benzoylanilino)methylene]propanedioate Diethyl 2-[(4-benzoylanilino)methylidene]propanedioate Diethyl 2-[[[4-(phenylcarbonyl)phenyl]amino]methylidene]propanedioate
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Formula C21H21NO5
InChI InChI=1S/C21H21NO5/c1-3-26-20(24)18(21(25)27-4-2)14-22-17-12-10-16(11-13-17)19(23)15-8-6-5-7-9-15/h5-14,22H,3-4H2,1-2H3
InChIKey KPVOCGPABUAUPB-UHFFFAOYSA-N
Molecular Weight 367.401 g/mol
SMILES N(C=C(C(=O)OCC)C(=O)OCC)c1ccc(cc1)C(c1ccccc1)=O
SPLASH splash10-0avi-1935000000-72c1009c7f33fabe3ad4
Source of Spectrum SO-0-323-2
Wiley ID 1542176