| SpectraBase Compound ID | BM33MLjjkRI |
|---|---|
| InChI | InChI=1S/C20H36O4/c1-3-5-7-9-11-13-17-23-19(21)15-16-20(22)24-18-14-12-10-8-6-4-2/h15-16H,3-14,17-18H2,1-2H3/b16-15- |
| InChIKey | TVWTZAGVNBPXHU-NXVVXOECSA-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 | Aj80EkuyX7t |
|---|---|
| Name | Dioctyl maleate |
| 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/c1-3-5-7-9-11-13-17-23-19(21)15-16-20(22)24-18-14-12-10-8-6-4-2/h15-16H,3-14,17-18H2,1-2H3/b16-15- |
| InChIKey | TVWTZAGVNBPXHU-NXVVXOECSA-N |
| Molecular Weight | 340.504 g/mol |
| SMILES | CCCCCCCCOC(=O)\C=C/C(=O)OCCCCCCCC |