| SpectraBase Spectrum ID |
7OzfTvctRUt |
| Name |
2-(5-Amino-4-cyano-3-(cyanomethyl)-1H-pyrazol-1-yl)-N-(4-chlorophenyl)-acetamide |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H11ClN6O |
| InChI |
InChI=1S/C14H11ClN6O/c15-9-1-3-10(4-2-9)19-13(22)8-21-14(18)11(7-17)12(20-21)5-6-16/h1-4H,5,8,18H2,(H,19,22) |
| InChIKey |
QBKBWHBKGBSONW-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP 1000 Ex |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3895 |
| Molecular Weight |
314.736 g/mol |
| SMILES |
Nc1c(c(n[n]1CC(=O)Nc1ccc(cc1)Cl)CC#N)C#N |
| SPLASH |
splash10-03di-4901000000-55b9e3810b514f8cdf9f |
| Source of Spectrum |
Y-57-SM6-7c |
| Wiley ID |
1860151 |
