| SpectraBase Compound ID | L2NWUe69WjV |
|---|---|
| InChI | InChI=1S/C13H9N3O4/c14-13(18)11-5-4-9(7-15-11)12(17)8-2-1-3-10(6-8)16(19)20/h1-7H,(H2,14,18) |
| InChIKey | MWWURSVEJBYTKT-UHFFFAOYSA-N |
| Mol Weight | 271.23 g/mol |
| Molecular Formula | C13H9N3O4 |
| Exact Mass | 271.059306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AaaRW9TW0aG |
|---|---|
| Name | 5-(3-Nitrobenzoyl)pyridine-2-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.059305778 u |
| Formula | C13H9N3O4 |
| InChI | InChI=1S/C13H9N3O4/c14-13(18)11-5-4-9(7-15-11)12(17)8-2-1-3-10(6-8)16(19)20/h1-7H,(H2,14,18) |
| InChIKey | MWWURSVEJBYTKT-UHFFFAOYSA-N |
| SMILES | C1(N(=O)=O)=CC(C(C2=CN=C(C(=O)N)C=C2)=O)=CC=C1 |