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

*Links on SpectraBase are not permalinks.
4-(4-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrrol-2(5H)-one
SpectraBase Compound ID 7W7nsSf39Hh
InChI InChI=1S/C19H12ClF3N4O/c20-14-5-1-12(2-6-14)16-9-26(18(28)17(16)27-11-24-10-25-27)15-7-3-13(4-8-15)19(21,22)23/h1-8,10-11H,9H2
InChIKey NFDVCIPJWUCNRI-UHFFFAOYSA-N
Mol Weight 404.78 g/mol
Molecular Formula C19H12ClF3N4O
Exact Mass 404.065173 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 FYQ3zmMzOSz
Name 4-(4-chlorophenyl)-3-(1H-1,2,4-triazol-1-yl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrrol-2(5H)-one
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12ClF3N4O
InChI InChI=1S/C19H12ClF3N4O/c20-14-5-1-12(2-6-14)16-9-26(18(28)17(16)27-11-24-10-25-27)15-7-3-13(4-8-15)19(21,22)23/h1-8,10-11H,9H2
InChIKey NFDVCIPJWUCNRI-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 404.780 g/mol
SMILES c1(Cl)ccc(cc1)C1=C(C(N(C1)c1ccc(cc1)C(F)(F)F)=O)[n]1ncnc1
SPLASH splash10-0udi-0431900000-a457b779160ea61ba102
Source of Spectrum CN106243087A
Wiley ID 1852914