| SpectraBase Compound ID | Km7YAfamIkz |
|---|---|
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21-2/h17,19H,3-16H2,1-2H3 |
| InChIKey | OJTSKRLQHYPZAM-UHFFFAOYSA-N |
| Mol Weight | 300.5 g/mol |
| Molecular Formula | C18H36O3 |
| Exact Mass | 300.266445 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ABDN1hGJlIJ |
|---|---|
| Name | 3-Hydroxymethyl heptadecanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.266445016 u |
| Formula | C18H36O3 |
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17(19)16-18(20)21-2/h17,19H,3-16H2,1-2H3 |
| InChIKey | OJTSKRLQHYPZAM-UHFFFAOYSA-N |
| Molecular Weight | 300.483 g/mol |
| SMILES | C(CCCCCCCCCCCC(O)CC(OC)=O)CC |