| SpectraBase Compound ID | HJbtAwQlL3h |
|---|---|
| InChI | InChI=1S/C20H38O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19-6-4-2/h10-11H,3-9,12-19H2,1-2H3/b11-10- |
| InChIKey | YWDFWMANHUYCIY-KHPPLWFESA-N |
| Mol Weight | 310.5 g/mol |
| Molecular Formula | C20H38O2 |
| Exact Mass | 310.28718 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AVpn0znrdo6 |
|---|---|
| Name | Butyl 9-hexadecenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 310.287180462 u |
| Formula | C20H38O2 |
| InChI | InChI=1S/C20H38O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19-6-4-2/h10-11H,3-9,12-19H2,1-2H3/b11-10- |
| InChIKey | YWDFWMANHUYCIY-KHPPLWFESA-N |
| Molecular Weight | 310.522 g/mol |
| SMILES | C(CCCCCC\C=C/CCCCCC)C(OCCCC)=O |