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

*Links on SpectraBase are not permalinks.

6-(4-bromophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

View entire compound with spectra: 2 MS (GC)

6-(4-bromophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID ErTz2qH6yS1
InChI InChI=1S/C20H16BrN7S/c1-12-3-9-16(10-4-12)27-13(2)18(22-26-27)19-23-24-20-28(19)25-17(11-29-20)14-5-7-15(21)8-6-14/h3-10H,11H2,1-2H3
InChIKey MYEOJIXLRJTVTQ-UHFFFAOYSA-N
Mol Weight 466.36 g/mol
Molecular Formula C20H16BrN7S
Exact Mass 465.037128 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 JvpBhuj5lfD
Name 6-(4-bromophenyl)-3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16BrN7S
InChI InChI=1S/C20H16BrN7S/c1-12-3-9-16(10-4-12)27-13(2)18(22-26-27)19-23-24-20-28(19)25-17(11-29-20)14-5-7-15(21)8-6-14/h3-10H,11H2,1-2H3
InChIKey MYEOJIXLRJTVTQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200000072
Molecular Weight 466.361 g/mol
SMILES c1cc(ccc1C)-[n]1nnc(c1C)-c1nnc2[n]1N=C(CS2)c1ccc(cc1)Br
SPLASH splash10-00kf-7910000000-299f5c55bdf223e88424
Source of Spectrum QA-47-543-6g
Synonyms 6-(4-bromophenyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Wiley ID 1795116