| SpectraBase Compound ID | 2iPoayn9gHi |
|---|---|
| InChI | InChI=1S/C20H36O4/c1-23-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)24-2/h3-4H,5-18H2,1-2H3 |
| InChIKey | HGGLIXDRUINGBB-UHFFFAOYSA-N |
| Mol Weight | 340.5 g/mol |
| Molecular Formula | C20H36O4 |
| Exact Mass | 340.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LiqBQMMjvjn |
|---|---|
| Name | 1,18-Octadec-9-enediate dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.261359635 u |
| Formula | C20H36O4 |
| InChI | InChI=1S/C20H36O4/c1-23-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)24-2/h3-4H,5-18H2,1-2H3 |
| InChIKey | HGGLIXDRUINGBB-UHFFFAOYSA-N |
| Molecular Weight | 340.504 g/mol |
| SMILES | COC(CCCCCCC\C=C\CCCCCCCC(OC)=O)=O |