| SpectraBase Compound ID | 5ZIiOvQgpoK |
|---|---|
| InChI | InChI=1S/C24H48O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)22-24(26)27-4-2/h23,25H,3-22H2,1-2H3 |
| InChIKey | VJPPKNNPTLDPFE-UHFFFAOYSA-N |
| Mol Weight | 384.6 g/mol |
| Molecular Formula | C24H48O3 |
| Exact Mass | 384.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pM6Dk3x2xb |
|---|---|
| Name | Ethyl 3-hydroxydocosanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.360345403 u |
| Formula | C24H48O3 |
| InChI | InChI=1S/C24H48O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)22-24(26)27-4-2/h23,25H,3-22H2,1-2H3 |
| InChIKey | VJPPKNNPTLDPFE-UHFFFAOYSA-N |
| Molecular Weight | 384.645 g/mol |
| SMILES | C(CC(CCCCCCCCCCCCCCCCCCC)O)(=O)OCC |