| SpectraBase Compound ID | 3qm4dp67Omo |
|---|---|
| InChI | InChI=1S/C34H64O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-33H2,1-2H3/b13-11-,19-17- |
| InChIKey | MJCPRFASSBVGQD-OHNCOSGTSA-N |
| Mol Weight | 504.9 g/mol |
| Molecular Formula | C34H64O2 |
| Exact Mass | 504.490631 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GL4g7mVvpaQ |
|---|---|
| Name | Palmityl linoleate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 504.490631299 u |
| Formula | C34H64O2 |
| InChI | InChI=1S/C34H64O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-33H2,1-2H3/b13-11-,19-17- |
| InChIKey | MJCPRFASSBVGQD-OHNCOSGTSA-N |
| Molecular Weight | 504.884 g/mol |
| SMILES | C(CCCCCCC\C=C/C\C=C/CCCCC)(=O)OCCCCCCCCCCCCCCCC |