| SpectraBase Compound ID | DIQ2QoXG20w |
|---|---|
| InChI | InChI=1S/C19H34O/c1-3-5-7-10-14-17(13-9-6-4-2)19(20)18-15-11-8-12-16-18/h14,18H,3-13,15-16H2,1-2H3/b17-14+ |
| InChIKey | DLZIPJMCMLBGNO-SAPNQHFASA-N |
| Mol Weight | 278.5 g/mol |
| Molecular Formula | C19H34O |
| Exact Mass | 278.260966 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G6LPKLSbzrx |
|---|---|
| Name | (E)-1-Cyclohexyl-2-pentyl-2-octen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.260965714 u |
| Formula | C19H34O |
| InChI | InChI=1S/C19H34O/c1-3-5-7-10-14-17(13-9-6-4-2)19(20)18-15-11-8-12-16-18/h14,18H,3-13,15-16H2,1-2H3/b17-14+ |
| InChIKey | DLZIPJMCMLBGNO-SAPNQHFASA-N |
| Molecular Weight | 278.480 g/mol |
| SMILES | C(\C(=C\CCCCC)CCCCC)(=O)C1CCCCC1 |