| SpectraBase Compound ID | DbSvtHRA2wU |
|---|---|
| InChI | InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h8-9H,3-7,10-17H2,1-2H3/b9-8+ |
| InChIKey | JNSUZRHLHDQGPN-CMDGGOBGSA-N |
| Mol Weight | 282.5 g/mol |
| Molecular Formula | C18H34O2 |
| Exact Mass | 282.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EfNcWkHs3pW |
|---|---|
| Name | Heptadec-(10E)-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.255880333 u |
| Formula | C18H34O2 |
| InChI | InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h8-9H,3-7,10-17H2,1-2H3/b9-8+ |
| InChIKey | JNSUZRHLHDQGPN-CMDGGOBGSA-N |
| Molecular Weight | 282.468 g/mol |
| SMILES | C(CCCCCCCC\C=C\CCCCCC)(=O)OC |