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Methyl 2-(4,6-diphenyl-2-pyrimidinylamino)benzoate

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Methyl 2-(4,6-diphenyl-2-pyrimidinylamino)benzoate
SpectraBase Compound ID KU97eFcxP8F
InChI InChI=1S/C24H19N3O2/c1-29-23(28)19-14-8-9-15-20(19)25-24-26-21(17-10-4-2-5-11-17)16-22(27-24)18-12-6-3-7-13-18/h2-16H,1H3,(H,25,26,27)
InChIKey XOQLGPYABGAZCJ-UHFFFAOYSA-N
Mol Weight 381.44 g/mol
Molecular Formula C24H19N3O2
Exact Mass 381.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID fwwQ9j8kAo
Name 2-(2-Carbomethoxyphenylamino)-4,6-diphenylpyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 381.147726862 u
Formula C24H19N3O2
InChI InChI=1S/C24H19N3O2/c1-29-23(28)19-14-8-9-15-20(19)25-24-26-21(17-10-4-2-5-11-17)16-22(27-24)18-12-6-3-7-13-18/h2-16H,1H3,(H,25,26,27)
InChIKey XOQLGPYABGAZCJ-UHFFFAOYSA-N
Molecular Weight 381.435 g/mol
SMILES C1(=NC(=CC(=N1)C1=CC=CC=C1)C1=CC=CC=C1)NC1=C(C=CC=C1)C(=O)OC