| SpectraBase Spectrum ID |
DzP6SQzREei |
| Name |
(4-Azido-3-(5-ethylthio-4-phenyl-4H-1,2,4-triazol-3-yl)-1-phenyl-1H-pyrazol-5-yl)(4-bromophenyl)methanone |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H19BrN8OS |
| InChI |
InChI=1S/C26H19BrN8OS/c1-2-37-26-31-30-25(34(26)19-9-5-3-6-10-19)22-21(29-33-28)23(24(36)17-13-15-18(27)16-14-17)35(32-22)20-11-7-4-8-12-20/h3-16H,2H2,1H3 |
| InChIKey |
MFIXWOAPRYSKSA-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2363 |
| Molecular Weight |
571.457 g/mol |
| SMILES |
c1(n[n](c(c1N=[N+]=[N-])C(c1ccc(cc1)Br)=O)-c1ccccc1)-c1nnc([n]1-c1ccccc1)SCC |
| SPLASH |
splash10-0006-6830090000-e8dd701ceeeaa2e94889 |
| Source of Spectrum |
Y-53-1165-8d |
| Wiley ID |
1876490 |
