| SpectraBase Compound ID | Guo3iFPPy3D |
|---|---|
| InChI | InChI=1S/2C6H5NO2.Na/c2*8-6(9)5-1-3-7-4-2-5;/h2*1-4H,(H,8,9);/q;;+1/p-1 |
| InChIKey | DANFAXHIMMTMSP-UHFFFAOYSA-M |
| Mol Weight | 268.2 g/mol |
| Molecular Formula | C12H9N2NaO4 |
| Exact Mass | 268.046001 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 4vr8LZFrzXb |
|---|---|
| Name | ISONICOTINIC ACID |
| Source of Sample | Chem Service, Inc., West Chester, Pennsylvania |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H5NO2 |
| InChI | InChI=1S/2C6H5NO2.Na/c2*8-6(9)5-1-3-7-4-2-5;/h2*1-4H,(H,8,9);/q;;+1/p-1 |
| InChIKey | DANFAXHIMMTMSP-UHFFFAOYSA-M |
| Melting Point | 317C |
| Molecular Weight | 123.11 |
| Solvent | Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20 |
| Synonyms | 4-PYRIDINECARBOXYLIC ACID |