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N-(4,6-Diphenylpyrimidin-2-yl)-3-methylbutanamide

View entire compound with spectra: 1 NMR

N-(4,6-Diphenylpyrimidin-2-yl)-3-methylbutanamide
SpectraBase Compound ID JxCxPhzOzif
InChI InChI=1S/C21H21N3O/c1-15(2)13-20(25)24-21-22-18(16-9-5-3-6-10-16)14-19(23-21)17-11-7-4-8-12-17/h3-12,14-15H,13H2,1-2H3,(H,22,23,24,25)
InChIKey RLCNDGHLHOXEDS-UHFFFAOYSA-N
Mol Weight 331.42 g/mol
Molecular Formula C21H21N3O
Exact Mass 331.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fa6pn2iuRq3
Name N-(4,6-Diphenylpyrimidin-2-yl)-3-methylbutanamide
Comments Computed using HOSE algorithm
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Exact Mass 331.168462307 u
Formula C21H21N3O
InChI InChI=1S/C21H21N3O/c1-15(2)13-20(25)24-21-22-18(16-9-5-3-6-10-16)14-19(23-21)17-11-7-4-8-12-17/h3-12,14-15H,13H2,1-2H3,(H,22,23,24,25)
InChIKey RLCNDGHLHOXEDS-UHFFFAOYSA-N
Molecular Weight 331.419 g/mol
SMILES C(NC1=NC(=CC(=N1)C1=CC=CC=C1)C1=CC=CC=C1)(CC(C)C)=O