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Ethyl 3-(4-methylphenyl)-3-[(4-nitrobenzoyl)amino]propanoate
SpectraBase Compound ID GXMpMbLSDRq
InChI InChI=1S/C19H20N2O5/c1-3-26-18(22)12-17(14-6-4-13(2)5-7-14)20-19(23)15-8-10-16(11-9-15)21(24)25/h4-11,17H,3,12H2,1-2H3,(H,20,23)
InChIKey COBGPSYRCIRVQW-UHFFFAOYSA-N
Mol Weight 356.38 g/mol
Molecular Formula C19H20N2O5
Exact Mass 356.137222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HgBwLaiznZs
Name Ethyl 3-(4-methylphenyl)-3-[(4-nitrobenzoyl)amino]propanoate
Comments Computed using HOSE algorithm
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Exact Mass 356.137221747 u
Formula C19H20N2O5
InChI InChI=1S/C19H20N2O5/c1-3-26-18(22)12-17(14-6-4-13(2)5-7-14)20-19(23)15-8-10-16(11-9-15)21(24)25/h4-11,17H,3,12H2,1-2H3,(H,20,23)
InChIKey COBGPSYRCIRVQW-UHFFFAOYSA-N
Molecular Weight 356.378 g/mol
SMILES CCOC(CC(NC(C1=CC=C(N(=O)=O)C=C1)=O)C1=CC=C(C=C1)C)=O