| SpectraBase Compound ID | 3GIXk0OBeX9 |
|---|---|
| InChI | InChI=1S/C16H26O4/c1-6-19-15(17)11-14(16(18)20-7-2)13(5)10-8-9-12(3)4/h9H,6-8,10-11H2,1-5H3/b14-13+ |
| InChIKey | LQNRWELDUMYLBS-BUHFOSPRSA-N |
| Mol Weight | 282.38 g/mol |
| Molecular Formula | C16H26O4 |
| Exact Mass | 282.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BwD1TVbBrxV |
|---|---|
| Name | Diethyl (1,5-dimethyl-4-hexenylidene)succinate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.183109313 u |
| Formula | C16H26O4 |
| InChI | InChI=1S/C16H26O4/c1-6-19-15(17)11-14(16(18)20-7-2)13(5)10-8-9-12(3)4/h9H,6-8,10-11H2,1-5H3/b14-13+ |
| InChIKey | LQNRWELDUMYLBS-BUHFOSPRSA-N |
| SMILES | C(\C(=C\(CCC=C(C)C)C)CC(=O)OCC)(=O)OCC |