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

*Links on SpectraBase are not permalinks.

1,4-Diphenyl-3-methyl pyrazoline-5-one

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

1,4-Diphenyl-3-methyl pyrazoline-5-one
SpectraBase Compound ID ExwAqiNyktu
InChI InChI=1S/C16H14N2O/c1-12-15(13-8-4-2-5-9-13)16(19)18(17-12)14-10-6-3-7-11-14/h2-11,15H,1H3
InChIKey UXFHZGKRWAEYAM-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C16H14N2O
Exact Mass 250.110613 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID CeiuFdUlMBt
Name 1,4-Diphenyl-3-methyl pyrazoline-5-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.110613078 u
Formula C16H14N2O
InChI InChI=1S/C16H14N2O/c1-12-15(13-8-4-2-5-9-13)16(19)18(17-12)14-10-6-3-7-11-14/h2-11,15H,1H3
InChIKey UXFHZGKRWAEYAM-UHFFFAOYSA-N
Molecular Weight 250.301 g/mol
SMILES C1(=NN(C(C1C=1C=CC=CC1)=O)C=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945398