| SpectraBase Spectrum ID |
90DkfmCCp5I |
| Name |
1H-Pyrazole, 5-(4-chlorophenyl)-1-(2,4-dinitrophenyl)-3-methyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
358.046882546 u |
| Formula |
C16H11ClN4O4 |
| InChI |
InChI=1S/C16H11ClN4O4/c1-10-8-15(11-2-4-12(17)5-3-11)19(18-10)14-7-6-13(20(22)23)9-16(14)21(24)25/h2-9H,1H3 |
| InChIKey |
YKXWQGYCENUTQW-UHFFFAOYSA-N |
| Molecular Weight |
358.741 g/mol |
| SMILES |
C=1(N2C(=CC(=N2)C)C=2C=CC(=CC2)Cl)C(N(=O)=O)=CC(N(=O)=O)=CC1 |
