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N-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)benzamide
SpectraBase Compound ID FpwKfal4Z1W
InChI InChI=1S/C17H15N3O/c1-13-12-16(18-17(21)14-8-4-2-5-9-14)20(19-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,18,21)
InChIKey USIZHCMJRHPTGY-UHFFFAOYSA-N
Mol Weight 277.33 g/mol
Molecular Formula C17H15N3O
Exact Mass 277.121512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J65TTW23XN7
Name N-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 277.121512114 u
Formula C17H15N3O
InChI InChI=1S/C17H15N3O/c1-13-12-16(18-17(21)14-8-4-2-5-9-14)20(19-13)15-10-6-3-7-11-15/h2-12H,1H3,(H,18,21)
InChIKey USIZHCMJRHPTGY-UHFFFAOYSA-N
SMILES C(NC=1N(N=C(C1)C)C1=CC=CC=C1)(=O)C1=CC=CC=C1