| SpectraBase Compound ID | 6IDvrsvcc1x |
|---|---|
| InChI | InChI=1S/C12H9N3O3/c16-12(10-6-3-4-8-13-10)14-9-5-1-2-7-11(9)15(17)18/h1-8H,(H,14,16) |
| InChIKey | VXQKWRRUKJXIBH-UHFFFAOYSA-N |
| Mol Weight | 243.22 g/mol |
| Molecular Formula | C12H9N3O3 |
| Exact Mass | 243.064391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7WiakMgSHBL |
|---|---|
| Name | Pyridine-2-carboxylic acid, (2-nitro-phenyl)-amide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.064391159 u |
| Formula | C12H9N3O3 |
| InChI | InChI=1S/C12H9N3O3/c16-12(10-6-3-4-8-13-10)14-9-5-1-2-7-11(9)15(17)18/h1-8H,(H,14,16) |
| InChIKey | VXQKWRRUKJXIBH-UHFFFAOYSA-N |
| Molecular Weight | 243.222 g/mol |
| SMILES | C1(=C(NC(C2=NC=CC=C2)=O)C=CC=C1)N(=O)=O |