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

*Links on SpectraBase are not permalinks.
[1,2,4]Triazolo[3,4-b][1,3,4]thiadiazole, 3-(3,4-dimethoxyphenyl)-6-(4-pyridinyl)-
SpectraBase Compound ID BGmVxzc3Byx
InChI InChI=1S/C16H13N5O2S/c1-22-12-4-3-11(9-13(12)23-2)14-18-19-16-21(14)20-15(24-16)10-5-7-17-8-6-10/h3-9H,1-2H3
InChIKey JBMPRIPJQCLBHD-UHFFFAOYSA-N
Mol Weight 339.37 g/mol
Molecular Formula C16H13N5O2S
Exact Mass 339.078996 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 BpBbbTbjmeF
Name [1,2,4]Triazolo[3,4-b][1,3,4]thiadiazole, 3-(3,4-dimethoxyphenyl)-6-(4-pyridinyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N5O2S
InChI InChI=1S/C16H13N5O2S/c1-22-12-4-3-11(9-13(12)23-2)14-18-19-16-21(14)20-15(24-16)10-5-7-17-8-6-10/h3-9H,1-2H3
InChIKey JBMPRIPJQCLBHD-UHFFFAOYSA-N
Molecular Weight 339.373 g/mol
SMILES COc1ccc(-c2[n]3c(SC(=N3)c3ccncc3)nn2)cc1OC
SPLASH splash10-03ki-5902000000-4e33ab5e25a87ceff503
Source of Spectrum IY-2-4791-2
Synonyms 3-(3,4-dimethoxyphenyl)-6-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Wiley ID 1655895