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

*Links on SpectraBase are not permalinks.
[(1,3-Diphenyl-1H-1,2,4-triazol-5-yl)imino](4-fluorophenyl)(methyl)-.lambda.6-sulfanone
SpectraBase Compound ID AQd8k9ZRQef
InChI InChI=1S/C21H17FN4OS/c1-28(27,19-14-12-17(22)13-15-19)25-21-23-20(16-8-4-2-5-9-16)24-26(21)18-10-6-3-7-11-18/h2-15H,1H3
InChIKey YZFWAVDXJVODNE-UHFFFAOYSA-N
Mol Weight 392.45 g/mol
Molecular Formula C21H17FN4OS
Exact Mass 392.110711 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 5O4GmWjcP2N
Name [(1,3-Diphenyl-1H-1,2,4-triazol-5-yl)imino](4-fluorophenyl)(methyl)-.lambda.6-sulfanone
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17FN4OS
InChI InChI=1S/C21H17FN4OS/c1-28(27,19-14-12-17(22)13-15-19)25-21-23-20(16-8-4-2-5-9-16)24-26(21)18-10-6-3-7-11-18/h2-15H,1H3
InChIKey YZFWAVDXJVODNE-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000335
Molecular Weight 392.452 g/mol
Reported Formula C21H17ON4FS
SMILES CS(c1ccc(cc1)F)(=Nc1[n](-c2ccccc2)nc(-c2ccccc2)n1)=O
SPLASH splash10-002f-4619000000-ef1068e808935951876d
Source of Spectrum U1-2020-SM4-7f
Wiley ID 1860524