| SpectraBase Spectrum ID |
6VJF8wQ3Lqy |
| Name |
4-Iodo-5-(methylthio)-1,3-diphenyl-1H-pyrazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13IN2S |
| InChI |
InChI=1S/C16H13IN2S/c1-20-16-14(17)15(12-8-4-2-5-9-12)18-19(16)13-10-6-3-7-11-13/h2-11H,1H3 |
| InChIKey |
KPWLXODZUAKUAW-UHFFFAOYSA-N |
| Molecular Weight |
392.258 g/mol |
| SMILES |
c1(c(c(-c2ccccc2)n[n]1-c1ccccc1)I)SC |
| SPLASH |
splash10-0006-0009000000-bac2242abba643815464 |
| Source of Spectrum |
F-67-2965-5b |
| Wiley ID |
1686207 |
