| SpectraBase Compound ID | 583yGSFbFVq |
|---|---|
| InChI | InChI=1S/C27H52O5/c1-4-6-8-9-10-11-12-13-14-16-22-31-26(28)19-17-20-27(29)32-24-25(21-23-30-3)18-15-7-5-2/h25H,4-24H2,1-3H3 |
| InChIKey | KWNSUGXRUOSMRS-UHFFFAOYSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C27H52O5 |
| Exact Mass | 456.381475 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JEEd0HwG4NG |
|---|---|
| Name | Glutaric acid, dodecyl 2-(2-methoxyethyl)heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 456.381474769 u |
| Formula | C27H52O5 |
| InChI | InChI=1S/C27H52O5/c1-4-6-8-9-10-11-12-13-14-16-22-31-26(28)19-17-20-27(29)32-24-25(21-23-30-3)18-15-7-5-2/h25H,4-24H2,1-3H3 |
| InChIKey | KWNSUGXRUOSMRS-UHFFFAOYSA-N |
| Molecular Weight | 456.708 g/mol |
| SMILES | CCCCCCCCCCCCOC(CCCC(OCC(CCCCC)CCOC)=O)=O |