| SpectraBase Compound ID | DaAAwM98a8b |
|---|---|
| InChI | InChI=1S/C18H34O11/c1-21-17(19)15-28-13-11-26-9-7-24-5-3-23-4-6-25-8-10-27-12-14-29-16-18(20)22-2/h3-16H2,1-2H3 |
| InChIKey | KGHDZCQDUQYSJU-UHFFFAOYSA-N |
| Mol Weight | 426.5 g/mol |
| Molecular Formula | C18H34O11 |
| Exact Mass | 426.210112 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ITCrUyRfT4 |
|---|---|
| Name | Dimethyl 3,6,9,12,15,18,21-heptaoxatricosane-1,23-dioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 426.210111904 u |
| Formula | C18H34O11 |
| InChI | InChI=1S/C18H34O11/c1-21-17(19)15-28-13-11-26-9-7-24-5-3-23-4-6-25-8-10-27-12-14-29-16-18(20)22-2/h3-16H2,1-2H3 |
| InChIKey | KGHDZCQDUQYSJU-UHFFFAOYSA-N |
| Molecular Weight | 426.459 g/mol |
| SMILES | C(OC)(COCCOCCOCCOCCOCCOCCOCC(OC)=O)=O |