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Propanedioic acid, [[(4-methylphenyl)amino](4-nitrophenyl)methylene]-, dimethyl ester
SpectraBase Compound ID G2l7tIMY5fi
InChI InChI=1S/C19H18N2O6/c1-12-4-8-14(9-5-12)20-17(16(18(22)26-2)19(23)27-3)13-6-10-15(11-7-13)21(24)25/h4-11,20H,1-3H3
InChIKey BHCHCFLROGEWJH-UHFFFAOYSA-N
Mol Weight 370.36 g/mol
Molecular Formula C19H18N2O6
Exact Mass 370.116486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EeyhB72aDkl
Name Propanedioic acid, [[(4-methylphenyl)amino](4-nitrophenyl)methylene]-, dimethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 370.116486302 u
Formula C19H18N2O6
InChI InChI=1S/C19H18N2O6/c1-12-4-8-14(9-5-12)20-17(16(18(22)26-2)19(23)27-3)13-6-10-15(11-7-13)21(24)25/h4-11,20H,1-3H3
InChIKey BHCHCFLROGEWJH-UHFFFAOYSA-N
Molecular Weight 370.361 g/mol
SMILES C(=C(NC=1C=CC(=CC1)C)C=1C=CC(N(=O)=O)=CC1)(C(=O)OC)C(=O)OC