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N-Phenyl-N-(.alpha.-benzoylbenzyl)-N'-(p-methylbenzyl)oxamide
SpectraBase Compound ID B0AQInZPKm0
InChI InChI=1S/C30H26N2O3/c1-22-17-19-23(20-18-22)21-31-29(34)30(35)32(26-15-9-4-10-16-26)27(24-11-5-2-6-12-24)28(33)25-13-7-3-8-14-25/h2-20,27H,21H2,1H3,(H,31,34)
InChIKey PMBWMPGMESHEKA-UHFFFAOYSA-N
Mol Weight 462.55 g/mol
Molecular Formula C30H26N2O3
Exact Mass 462.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EM5bBHNoQGs
Name N-Phenyl-N-(.alpha.-benzoylbenzyl)-N'-(p-methylbenzyl)oxamide
Comments Computed using HOSE algorithm
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Exact Mass 462.194342702 u
Formula C30H26N2O3
InChI InChI=1S/C30H26N2O3/c1-22-17-19-23(20-18-22)21-31-29(34)30(35)32(26-15-9-4-10-16-26)27(24-11-5-2-6-12-24)28(33)25-13-7-3-8-14-25/h2-20,27H,21H2,1H3,(H,31,34)
InChIKey PMBWMPGMESHEKA-UHFFFAOYSA-N
Molecular Weight 462.549 g/mol
SMILES C(C(=O)NCC=1C=CC(=CC1)C)(=O)N(C(C=1C=CC=CC1)C(C=1C=CC=CC1)=O)C=1C=CC=CC1