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

*Links on SpectraBase are not permalinks.
4-Amino-3-[2-(p-toluenesulfonylethynyl)phenyl]-1,2,4-triazole
SpectraBase Compound ID 9muHzdOMHe4
InChI InChI=1S/C17H14N4O2S/c1-13-6-8-15(9-7-13)24(22,23)11-10-14-4-2-3-5-16(14)17-20-19-12-21(17)18/h2-9,12H,18H2,1H3
InChIKey WBWSMYYGHZGLEP-UHFFFAOYSA-N
Mol Weight 338.39 g/mol
Molecular Formula C17H14N4O2S
Exact Mass 338.083747 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 B3dn2zA3Azg
Name 4-Amino-3-[2-(p-toluenesulfonylethynyl)phenyl]-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N4O2S
InChI InChI=1S/C17H14N4O2S/c1-13-6-8-15(9-7-13)24(22,23)11-10-14-4-2-3-5-16(14)17-20-19-12-21(17)18/h2-9,12H,18H2,1H3
InChIKey WBWSMYYGHZGLEP-UHFFFAOYSA-N
Molecular Weight 338.385 g/mol
SMILES N[n]1c(nnc1)-c1c(C#CS(c2ccc(cc2)C)(=O)=O)cccc1
SPLASH splash10-0019-0729000000-e0e7d50bbd482199fea5
Source of Spectrum Y-51-1587-5
Synonyms 3-(2-(tosylethynyl)phenyl)-4H-1,2,4-triazol-4-amine
Wiley ID 1741670