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

*Links on SpectraBase are not permalinks.
4H-1,2,4-Triazole, 3-[(2-chloro-1,2-diphenylethyl)thio]-5-methyl-4-phenyl-
SpectraBase Compound ID 560qaB7lr3X
InChI InChI=1S/C23H20ClN3S/c1-17-25-26-23(27(17)20-15-9-4-10-16-20)28-22(19-13-7-3-8-14-19)21(24)18-11-5-2-6-12-18/h2-16,21-22H,1H3
InChIKey JXOOERAYTVIZGP-UHFFFAOYSA-N
Mol Weight 405.95 g/mol
Molecular Formula C23H20ClN3S
Exact Mass 405.106647 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 DI8CdePwYIT
Name 4H-1,2,4-Triazole, 3-[(2-chloro-1,2-diphenylethyl)thio]-5-methyl-4-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20ClN3S
InChI InChI=1S/C23H20ClN3S/c1-17-25-26-23(27(17)20-15-9-4-10-16-20)28-22(19-13-7-3-8-14-19)21(24)18-11-5-2-6-12-18/h2-16,21-22H,1H3
InChIKey JXOOERAYTVIZGP-UHFFFAOYSA-N
Molecular Weight 405.947 g/mol
SMILES c1ccccc1C(C(Sc1[n](c(C)nn1)-c1ccccc1)c1ccccc1)Cl
SPLASH splash10-004i-3920000000-5d864c8fe675bbbe65ab
Source of Spectrum IY-1-4523-8
Wiley ID 1653221