| SpectraBase Compound ID | GoLW4GxeA2T |
|---|---|
| InChI | InChI=1S/C21H42O/c1-4-7-10-12-13-16-19-21(22)20(17-14-9-6-3)18-15-11-8-5-2/h18,21-22H,4-17,19H2,1-3H3/b20-18- |
| InChIKey | MRXDEORBFHQTRV-ZZEZOPTASA-N |
| Mol Weight | 310.6 g/mol |
| Molecular Formula | C21H42O |
| Exact Mass | 310.323566 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IWwzdZNQ4b7 |
|---|---|
| Name | 7-Pentyl-6-hexadecen-8-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.323565971 u |
| Formula | C21H42O |
| InChI | InChI=1S/C21H42O/c1-4-7-10-12-13-16-19-21(22)20(17-14-9-6-3)18-15-11-8-5-2/h18,21-22H,4-17,19H2,1-3H3/b20-18- |
| InChIKey | MRXDEORBFHQTRV-ZZEZOPTASA-N |
| Molecular Weight | 310.566 g/mol |
| SMILES | C(\C=C/(C(O)CCCCCCCC)CCCCC)CCCC |