| SpectraBase Compound ID | Bkgbp72N0qQ |
|---|---|
| InChI | InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9) |
| InChIKey | VFQXVTODMYMSMJ-UHFFFAOYSA-N |
| Mol Weight | 122.13 g/mol |
| Molecular Formula | C6H6N2O |
| Exact Mass | 122.048013 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3KNcZEihQeX |
|---|---|
| Name | ISONICOTINAMIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H6N2O |
| InChI | InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9) |
| InChIKey | VFQXVTODMYMSMJ-UHFFFAOYSA-N |
| Molecular Weight | 122.0479 |
| SMILES | NC(=O)c1ccncc1 |
| SPLASH | splash10-0ufr-9300000000-777082c1874858937260 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |