| SpectraBase Compound ID | GQwDS1SaJDX |
|---|---|
| InChI | InChI=1S/C20H34O6/c1-25-19(23)15-17(21)13-11-9-7-5-3-4-6-8-10-12-14-18(22)16-20(24)26-2/h3-16H2,1-2H3 |
| InChIKey | HNPDKNPLNSBWQO-UHFFFAOYSA-N |
| Mol Weight | 370.5 g/mol |
| Molecular Formula | C20H34O6 |
| Exact Mass | 370.235539 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GD8UYd0whLD |
|---|---|
| Name | Octadecanedioic acid, 3,16-dioxo-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.235538809 u |
| Formula | C20H34O6 |
| InChI | InChI=1S/C20H34O6/c1-25-19(23)15-17(21)13-11-9-7-5-3-4-6-8-10-12-14-18(22)16-20(24)26-2/h3-16H2,1-2H3 |
| InChIKey | HNPDKNPLNSBWQO-UHFFFAOYSA-N |
| Molecular Weight | 370.486 g/mol |
| SMILES | C(C(CCCCCCCCCCCCC(CC(OC)=O)=O)=O)C(OC)=O |