| SpectraBase Compound ID | J1s6uwIHh4r |
|---|---|
| InChI | InChI=1S/C9H7N3O2/c13-12(14)9-6-10-11(7-9)8-4-2-1-3-5-8/h1-7H |
| InChIKey | IATFOGDERDNVMS-UHFFFAOYSA-N |
| Mol Weight | 189.17 g/mol |
| Molecular Formula | C9H7N3O2 |
| Exact Mass | 189.053826 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BHfjKJYRDPq |
|---|---|
| Name | 1H-Pyrazole, 4-nitro-1-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.053826475 u |
| Formula | C9H7N3O2 |
| InChI | InChI=1S/C9H7N3O2/c13-12(14)9-6-10-11(7-9)8-4-2-1-3-5-8/h1-7H |
| InChIKey | IATFOGDERDNVMS-UHFFFAOYSA-N |
| Molecular Weight | 189.174 g/mol |
| SMILES | C1(=CC=CC=C1)N1C=C(C=N1)N(=O)=O |