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

*Links on SpectraBase are not permalinks.

4-(o-chlorophenyl)-5-(phenacylthio)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide

View entire compound with spectra: 1 FTIR, and 1 UV-Vis

4-(o-chlorophenyl)-5-(phenacylthio)-4H-1,2,4-triazole-3-acetonitrile, monohydrobromide
SpectraBase Compound ID KRk8Un1Tv9o
InChI InChI=1S/C18H13ClN4OS.BrH/c19-14-8-4-5-9-15(14)23-17(10-11-20)21-22-18(23)25-12-16(24)13-6-2-1-3-7-13;/h1-9H,10,12H2;1H
InChIKey QQZCRPXMYFOTEG-UHFFFAOYSA-N
Mol Weight 449.754 g/mol
Molecular Formula C18H14BrClN4OS
Exact Mass 447.976023 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1B1GF8r7JwF
Name 4-(o-CHLOROPHENYL)-5-(PHENACYLTHIO)-4H-1,2,4-TRIAZOLE-3-ACETONITRILE, MONOHYDROBROMIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 2567
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14BrClN4OS
InChI InChI=1S/C18H13ClN4OS.BrH/c19-14-8-4-5-9-15(14)23-17(10-11-20)21-22-18(23)25-12-16(24)13-6-2-1-3-7-13;/h1-9H,10,12H2;1H
InChIKey QQZCRPXMYFOTEG-UHFFFAOYSA-N
Melting Point 196-198C
Molecular Weight 449.756989
Synonyms TRIAZOLE-3-ACETONITRILE, 4H-1,2,4-, 4-/O-CHLOROPHENYL/-5-/PHENACYLTHIO/-, MONOHYDROBROMIDE
Technique KBr WAFER