| SpectraBase Compound ID | LCy8pLmZcIn |
|---|---|
| InChI | InChI=1S/C10H7N3O4/c14-10(15)7-5-11-12(6-7)8-1-3-9(4-2-8)13(16)17/h1-6H,(H,14,15) |
| InChIKey | FHLYLGPMPNMDKU-UHFFFAOYSA-N |
| Mol Weight | 233.18 g/mol |
| Molecular Formula | C10H7N3O4 |
| Exact Mass | 233.043656 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1IqOtd1KUGv |
|---|---|
| Name | 1-(4-Nitrophenyl)pyrazole-4-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.043655713 u |
| Formula | C10H7N3O4 |
| InChI | InChI=1S/C10H7N3O4/c14-10(15)7-5-11-12(6-7)8-1-3-9(4-2-8)13(16)17/h1-6H,(H,14,15) |
| InChIKey | FHLYLGPMPNMDKU-UHFFFAOYSA-N |
| Molecular Weight | 233.183 g/mol |
| SMILES | C(O)(C1=CN(C=2C=CC(N(=O)=O)=CC2)N=C1)=O |