| SpectraBase Compound ID | 1Pi6pAvEeDw |
|---|---|
| InChI | InChI=1S/C23H46O/c1-7-18-24-19-17-23(6)16-10-15-22(5)14-9-13-21(4)12-8-11-20(2)3/h17,20-22H,7-16,18-19H2,1-6H3/b23-17+ |
| InChIKey | ZHFOQAFXTMCNCE-HAVVHWLPSA-N |
| Mol Weight | 338.6 g/mol |
| Molecular Formula | C23H46O |
| Exact Mass | 338.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JzhOytxY3jJ |
|---|---|
| Name | Phytyl propyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.354866100 u |
| Formula | C23H46O |
| InChI | InChI=1S/C23H46O/c1-7-18-24-19-17-23(6)16-10-15-22(5)14-9-13-21(4)12-8-11-20(2)3/h17,20-22H,7-16,18-19H2,1-6H3/b23-17+ |
| InChIKey | ZHFOQAFXTMCNCE-HAVVHWLPSA-N |
| Molecular Weight | 338.620 g/mol |
| SMILES | C(\C=C\(CCCC(CCCC(CCCC(C)C)C)C)C)OCCC |