| SpectraBase Compound ID | KxKx5XlNtgD |
|---|---|
| InChI | InChI=1S/C6H7NO3/c7-4-3-5(8)1-2-6(9)10/h1-3H2,(H,9,10) |
| InChIKey | FXMXIVOCBFWTPO-UHFFFAOYSA-N |
| Mol Weight | 141.13 g/mol |
| Molecular Formula | C6H7NO3 |
| Exact Mass | 141.042593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GQxYcRuSMoA |
|---|---|
| Name | 5-cyano-4-keto-valeric acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7NO3 |
| InChI | InChI=1S/C6H7NO3/c7-4-3-5(8)1-2-6(9)10/h1-3H2,(H,9,10) |
| InChIKey | FXMXIVOCBFWTPO-UHFFFAOYSA-N |
| Molecular Weight | 141.126 g/mol |
| SMILES | OC(CCC(CC#N)=O)=O |
| SPLASH | splash10-0udi-5900000000-1e43ab33d35916e283c0 |
| Source of Spectrum | J-57-5012-12 |
| Synonyms | 5-cyano-4-oxidanylidene-pentanoic acid 5-cyano-4-oxo-pentanoic acid |
| Wiley ID | 1140122 |