SpectraBase Spectrum ID |
FWGY6jx7TAa |
Name |
Thiazolo[5,4-e]-1,2,4-triazine, 3-(1,1-dimethylethyl)-6-(4-nitrophenyl)- |
CAS Registry Number |
112418-25-4 |
Comments |
Removed - expert review: contamination (sulfur)) |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H13N5O2S |
InChI |
InChI=1S/C14H13N5O2S/c1-14(2,3)13-16-12-10(17-18-13)15-11(22-12)8-4-6-9(7-5-8)19(20)21/h4-7H,1-3H3 |
InChIKey |
QTGWZHSVQZUTFT-UHFFFAOYSA-N |
Molecular Weight |
315.351 g/mol |
SMILES |
c12nc(sc2nc(nn1)C(C)(C)C)-c1ccc(N(=O)=O)cc1 |
SPLASH |
splash10-03fr-9810000000-d848031f33cbf9411c58 |
Source of Spectrum |
B-40-498-11 |
Synonyms |
2-(p-nitrophenyl)thiazolo[5,4-e]-1,2,4-[3-t-butyl]triazine
3-tert-butyl-6-(4-nitrophenyl)[1,3]thiazolo[5,4-e][1,2,4]triazine |
Wiley ID |
1315827 |