![3-[(o-Carbamoylphenyl)carbamoyl]picolinic acid](/api/spectrum/IOrihHjsJMn/structure.png?h=300&w=458 "3-[(o-Carbamoylphenyl)carbamoyl]picolinic acid")
| SpectraBase Compound ID | tTQdLSZQ2r |
|---|---|
| InChI | InChI=1S/C14H11N3O4/c15-12(18)8-4-1-2-6-10(8)17-13(19)9-5-3-7-16-11(9)14(20)21/h1-7H,(H2,15,18)(H,17,19)(H,20,21) |
| InChIKey | RBCAVWZYEGUKHM-UHFFFAOYSA-N |
| Mol Weight | 285.26 g/mol |
| Molecular Formula | C14H11N3O4 |
| Exact Mass | 285.074956 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IOrihHjsJMn |
|---|---|
| Name | 3-[(o-Carbamoylphenyl)carbamoyl]picolinic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.074955842 u |
| Formula | C14H11N3O4 |
| InChI | InChI=1S/C14H11N3O4/c15-12(18)8-4-1-2-6-10(8)17-13(19)9-5-3-7-16-11(9)14(20)21/h1-7H,(H2,15,18)(H,17,19)(H,20,21) |
| InChIKey | RBCAVWZYEGUKHM-UHFFFAOYSA-N |
| Molecular Weight | 285.259 g/mol |
| SMILES | OC(C1=NC=CC=C1C(=O)NC=1C(C(=O)N)=CC=CC1)=O |