| SpectraBase Compound ID | DAALWzbac8C |
|---|---|
| InChI | InChI=1S/C13H10N2O4/c16-13(17)9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15(18)19/h1-8,14H,(H,16,17) |
| InChIKey | FJNZXTAFUISVCI-UHFFFAOYSA-N |
| Mol Weight | 258.23 g/mol |
| Molecular Formula | C13H10N2O4 |
| Exact Mass | 258.064057 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | CTE9oVTB7U |
|---|---|
| Name | N-(o-Nitrophenyl)anthranilic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.064056806 u |
| Formula | C13H10N2O4 |
| InChI | InChI=1S/C13H10N2O4/c16-13(17)9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15(18)19/h1-8,14H,(H,16,17) |
| InChIKey | FJNZXTAFUISVCI-UHFFFAOYSA-N |
| SMILES | OC(C=1C(=CC=CC1)NC1=CC=CC=C1N(=O)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.849371 |