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

*Links on SpectraBase are not permalinks.
2-[1-Phenyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]acetaldehyde
SpectraBase Compound ID BfO1nAicYZP
InChI InChI=1S/C12H9F3N2O/c13-12(14,15)11-8-9(6-7-18)16-17(11)10-4-2-1-3-5-10/h1-5,7-8H,6H2
InChIKey CKESNEGWNYXXMR-UHFFFAOYSA-N
Mol Weight 254.21 g/mol
Molecular Formula C12H9F3N2O
Exact Mass 254.066697 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 2QVRwB0pMYX
Name 2-[1-Phenyl-5-(trifluoromethyl)-1H-pyrazol-3-yl]acetaldehyde
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F3N2O
InChI InChI=1S/C12H9F3N2O/c13-12(14,15)11-8-9(6-7-18)16-17(11)10-4-2-1-3-5-10/h1-5,7-8H,6H2
InChIKey CKESNEGWNYXXMR-UHFFFAOYSA-N
Instrument Name HP 5973-6890
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.164
Molecular Weight 254.212 g/mol
SMILES C(C=O)c1n[n](c(c1)C(F)(F)F)-c1ccccc1
SPLASH splash10-004i-1090000000-073042ec354cf5c25ffc
Source of Spectrum ARK-2013-301-7e
Wiley ID 1853644