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

*Links on SpectraBase are not permalinks.
1H-[1,2,4]Triazole-3-carboxylic acid [2-(4-chloro-phenyl)-ethyl]-amide
SpectraBase Compound ID HcT1LG98XQt
InChI InChI=1S/C11H11ClN4O/c12-9-3-1-8(2-4-9)5-6-13-11(17)10-14-7-15-16-10/h1-4,7H,5-6H2,(H,13,17)(H,14,15,16)
InChIKey YKGHTVVZVCJRDQ-UHFFFAOYSA-N
Mol Weight 250.69 g/mol
Molecular Formula C11H11ClN4O
Exact Mass 250.062139 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 JuCGql3oG
Name 1H-[1,2,4]Triazole-3-carboxylic acid [2-(4-chloro-phenyl)-ethyl]-amide
Alternate Name(s) N-[2-(4-Chlorophenyl)ethyl]-1H-1,2,4-triazole-3-carboxamide N-[2-(4-chlorophenyl)ethyl]-1H-1,2,4-triazole-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN4O
InChI InChI=1S/C11H11ClN4O/c12-9-3-1-8(2-4-9)5-6-13-11(17)10-14-7-15-16-10/h1-4,7H,5-6H2,(H,13,17)(H,14,15,16)
InChIKey YKGHTVVZVCJRDQ-UHFFFAOYSA-N
Molecular Weight 250.689 g/mol
SMILES [nH]1cnc(C(=O)NCCc2ccc(cc2)Cl)n1
SPLASH splash10-002v-5900000000-82e16d8aef6c3920087d
Wiley ID 1464623