| SpectraBase Compound ID | 4ljiDsYPcal |
|---|---|
| InChI | InChI=1S/C13H26O3/c1-16-13(15)11-9-7-5-3-2-4-6-8-10-12-14/h14H,2-12H2,1H3 |
| InChIKey | WVYBBOXJKXXXOY-UHFFFAOYSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C13H26O3 |
| Exact Mass | 230.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2tIsARoMWes |
|---|---|
| Name | Dodecanoic acid, 12-hydroxy-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.188194694 u |
| Formula | C13H26O3 |
| InChI | InChI=1S/C13H26O3/c1-16-13(15)11-9-7-5-3-2-4-6-8-10-12-14/h14H,2-12H2,1H3 |
| InChIKey | WVYBBOXJKXXXOY-UHFFFAOYSA-N |
| Molecular Weight | 230.348 g/mol |
| SMILES | OCCCCCCCCCCCC(=O)OC |