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3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide, N-methyl
SpectraBase Compound ID JefckNpNQEt
InChI InChI=1S/C24H18N4O/c1-27(24(29)20-12-8-9-18(15-20)17-25)23-16-22(19-10-4-2-5-11-19)26-28(23)21-13-6-3-7-14-21/h2-16H,1H3
InChIKey XKXOLMUOSCSDEH-UHFFFAOYSA-N
Mol Weight 378.44 g/mol
Molecular Formula C24H18N4O
Exact Mass 378.148061 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRXXOswVfFM
Name 3-Cyano-N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamide, N-methyl
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.148061215 u
Formula C24H18N4O
InChI InChI=1S/C24H18N4O/c1-27(24(29)20-12-8-9-18(15-20)17-25)23-16-22(19-10-4-2-5-11-19)26-28(23)21-13-6-3-7-14-21/h2-16H,1H3
InChIKey XKXOLMUOSCSDEH-UHFFFAOYSA-N
Molecular Weight 378.435 g/mol
SMILES C1(=NN(C(=C1)N(C(=O)C1=CC(=CC=C1)C#N)C)C1=CC=CC=C1)C1=CC=CC=C1