| SpectraBase Compound ID | JdD1iehHU9M |
|---|---|
| InChI | InChI=1S/C7H11NO2/c1-6(5-8)3-2-4-7(9)10/h6H,2-4H2,1H3,(H,9,10) |
| InChIKey | DKEPFHGTUJXFLS-UHFFFAOYSA-N |
| Mol Weight | 141.17 g/mol |
| Molecular Formula | C7H11NO2 |
| Exact Mass | 141.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ATV3rSy6Fa3 |
|---|---|
| Name | 5-Cyanohexanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO2 |
| InChI | InChI=1S/C7H11NO2/c1-6(5-8)3-2-4-7(9)10/h6H,2-4H2,1H3,(H,9,10) |
| InChIKey | DKEPFHGTUJXFLS-UHFFFAOYSA-N |
| Molecular Weight | 141.170 g/mol |
| SMILES | OC(CCCC(C#N)C)=O |
| SPLASH | splash10-05mp-9100000000-d51af8548ccf813e2177 |
| Source of Spectrum | F-48-9534-3 |
| Wiley ID | 1140239 |