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

*Links on SpectraBase are not permalinks.
3-Acetyl-5-(.beta.-styryl)-1-(4-tolyl)pyrazole-4-carbonitrile
SpectraBase Compound ID IgGE8EF7MxE
InChI InChI=1S/C21H17N3O/c1-15-8-11-18(12-9-15)24-20(13-10-17-6-4-3-5-7-17)19(14-22)21(23-24)16(2)25/h3-13H,1-2H3
InChIKey UTNUOSIITASYMW-UHFFFAOYSA-N
Mol Weight 327.39 g/mol
Molecular Formula C21H17N3O
Exact Mass 327.137162 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 6iL5aHDngiu
Name 3-Acetyl-5-(.beta.-styryl)-1-(4-tolyl)pyrazole-4-carbonitrile
Appearance Solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3O
InChI InChI=1S/C21H17N3O/c1-15-8-11-18(12-9-15)24-20(13-10-17-6-4-3-5-7-17)19(14-22)21(23-24)16(2)25/h3-13H,1-2H3
InChIKey UTNUOSIITASYMW-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2013.10.029
Molecular Weight 327.387 g/mol
SMILES C(C)(=O)c1n[n](c(c1C#N)C=Cc1ccccc1)-c1ccc(cc1)C
SPLASH splash10-004i-9000000000-9b80204fe6afbb2eaf15
Source of Spectrum AJC-10-S2784-28b
Wiley ID 1857197