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

*Links on SpectraBase are not permalinks.

3-Methyl-5-(4-nitrophenyl)-1-phenyl-pyrazole

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

3-Methyl-5-(4-nitrophenyl)-1-phenyl-pyrazole
SpectraBase Compound ID A3JDoelGFr7
InChI InChI=1S/C16H13N3O2/c1-12-11-16(13-7-9-15(10-8-13)19(20)21)18(17-12)14-5-3-2-4-6-14/h2-11H,1H3
InChIKey XDNLGHMVSAIZCV-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C16H13N3O2
Exact Mass 279.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4dwF3D2wv2m
Name 3-Methyl-5-(4-nitrophenyl)-1-phenyl-pyrazole
CAS Registry Number 108718-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O2
InChI InChI=1S/C16H13N3O2/c1-12-11-16(13-7-9-15(10-8-13)19(20)21)18(17-12)14-5-3-2-4-6-14/h2-11H,1H3
InChIKey XDNLGHMVSAIZCV-UHFFFAOYSA-N
Molecular Weight 279.299 g/mol
SMILES c1([n](nc(c1)C)-c1ccccc1)-c1ccc(N(=O)=O)cc1
SPLASH splash10-004i-3090000000-3e753f83a2831bd174af
Source of Spectrum J-53-1978-4
Wiley ID 1283008