| SpectraBase Compound ID | 5TZPbS10frs |
|---|---|
| InChI | InChI=1S/C19H30O4/c1-3-4-8-12-17(20)18-15-14-16(23-18)11-9-6-5-7-10-13-19(21)22-2/h14-15H,3-13H2,1-2H3 |
| InChIKey | QZFYDDVSJMDONK-UHFFFAOYSA-N |
| Mol Weight | 322.45 g/mol |
| Molecular Formula | C19H30O4 |
| Exact Mass | 322.214409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CjhFYgwlfA9 |
|---|---|
| Name | Methyl 13-oxo-9,12-epoxy-9,11-octadecadienoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.214409442 u |
| Formula | C19H30O4 |
| InChI | InChI=1S/C19H30O4/c1-3-4-8-12-17(20)18-15-14-16(23-18)11-9-6-5-7-10-13-19(21)22-2/h14-15H,3-13H2,1-2H3 |
| InChIKey | QZFYDDVSJMDONK-UHFFFAOYSA-N |
| Molecular Weight | 322.445 g/mol |
| SMILES | C=1(OC(=CC1)C(CCCCC)=O)CCCCCCCC(OC)=O |