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N-(1,3-Diphenyl-1H-pyrazol-5-yl)benzamide
SpectraBase Compound ID 9WvLqnchO2S
InChI InChI=1S/C22H17N3O/c26-22(18-12-6-2-7-13-18)23-21-16-20(17-10-4-1-5-11-17)24-25(21)19-14-8-3-9-15-19/h1-16H,(H,23,26)
InChIKey AYVLYDAJDALPHK-UHFFFAOYSA-N
Mol Weight 339.4 g/mol
Molecular Formula C22H17N3O
Exact Mass 339.137162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lFiB8FYN0E
Name N-(1,3-Diphenyl-1H-pyrazol-5-yl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 339.137162178 u
Formula C22H17N3O
InChI InChI=1S/C22H17N3O/c26-22(18-12-6-2-7-13-18)23-21-16-20(17-10-4-1-5-11-17)24-25(21)19-14-8-3-9-15-19/h1-16H,(H,23,26)
InChIKey AYVLYDAJDALPHK-UHFFFAOYSA-N
Molecular Weight 339.398 g/mol
SMILES C(NC=1N(N=C(C1)C1=CC=CC=C1)C1=CC=CC=C1)(=O)C1=CC=CC=C1