| SpectraBase Compound ID | 8sjtwbCSNxl |
|---|---|
| InChI | InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)/i3D,4D |
| InChIKey | TWBYWOBDOCUKOW-NMQOAUCRSA-N |
| Mol Weight | 125.12 g/mol |
| Molecular Formula | C6H3D2NO2 |
| Exact Mass | 125.044582 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L7ZBxEUeQG6 |
|---|---|
| Name | Isonicotinic acid-D1-.alpha.-D2 |
| CAS Registry Number | 55090-48-7 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H2D3NO2 |
| SPLASH | splash10-004i-0900000000-4bc0907161f6283cf622 |
| Source of Spectrum | O-5-736-4 |
| Synonyms | 2,6-Dideutero pyridine-4-carboxylic acid |
| Wiley ID | 4314 |