For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Benzylidene-2,5-diphenyl-2,4-dihydro-pyrazol-3-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4-Benzylidene-2,5-diphenyl-2,4-dihydro-pyrazol-3-one
SpectraBase Compound ID 9JOvhVNOSHH
InChI InChI=1S/C22H16N2O/c25-22-20(16-17-10-4-1-5-11-17)21(18-12-6-2-7-13-18)23-24(22)19-14-8-3-9-15-19/h1-16H/b20-16-
InChIKey SKMUCGLPDCMKBF-SILNSSARSA-N
Mol Weight 324.38 g/mol
Molecular Formula C22H16N2O
Exact Mass 324.126263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JH099OyFwEo
Name 4-Benzylidene-2,5-diphenyl-2,4-dihydro-pyrazol-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.126263142 u
Formula C22H16N2O
InChI InChI=1S/C22H16N2O/c25-22-20(16-17-10-4-1-5-11-17)21(18-12-6-2-7-13-18)23-24(22)19-14-8-3-9-15-19/h1-16H/b20-16-
InChIKey SKMUCGLPDCMKBF-SILNSSARSA-N
Molecular Weight 324.383 g/mol
SMILES C1(\C(C(=NN1C1=CC=CC=C1)C=1C=CC=CC1)=C/C=1C=CC=CC1)=O