| SpectraBase Compound ID | AV5iMHXqxkE |
|---|---|
| InChI | InChI=1S/C26H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(27)28-23-22-25(4)20-18-19-24(2)3/h19,25H,5-18,20-23H2,1-4H3 |
| InChIKey | YTGIONGRGTWTNY-UHFFFAOYSA-N |
| Mol Weight | 394.7 g/mol |
| Molecular Formula | C26H50O2 |
| Exact Mass | 394.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FEguhIt9pWk |
|---|---|
| Name | 3,7-Dimethyloct-6-en-1-yl palmitate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 394.381080848 u |
| Formula | C26H50O2 |
| InChI | InChI=1S/C26H50O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(27)28-23-22-25(4)20-18-19-24(2)3/h19,25H,5-18,20-23H2,1-4H3 |
| InChIKey | YTGIONGRGTWTNY-UHFFFAOYSA-N |
| Molecular Weight | 394.684 g/mol |
| SMILES | C(CCCCCCCCCCCCCCC)(=O)OCCC(CCC=C(C)C)C |