| SpectraBase Compound ID | 6tShkI3crEy |
|---|---|
| InChI | InChI=1S/C21H38O2/c1-6-7-8-15-21(22)23-17-16-20(5)14-10-13-19(4)12-9-11-18(2)3/h11,13,20H,6-10,12,14-17H2,1-5H3/b19-13+ |
| InChIKey | OVGPJUKPIAHWGH-CPNJWEJPSA-N |
| Mol Weight | 322.5 g/mol |
| Molecular Formula | C21H38O2 |
| Exact Mass | 322.28718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 86Gy0ipkTrB |
|---|---|
| Name | 2,3-Dihydrofarnesyl hexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.287180462 u |
| Formula | C21H38O2 |
| InChI | InChI=1S/C21H38O2/c1-6-7-8-15-21(22)23-17-16-20(5)14-10-13-19(4)12-9-11-18(2)3/h11,13,20H,6-10,12,14-17H2,1-5H3/b19-13+ |
| InChIKey | OVGPJUKPIAHWGH-CPNJWEJPSA-N |
| Molecular Weight | 322.533 g/mol |
| SMILES | CC(C)=CCC\C(=C\CCC(CCOC(CCCCC)=O)C)C |