| SpectraBase Compound ID | DMDQHuQ7xFf |
|---|---|
| InChI | InChI=1S/C17H30O4/c1-5-8-10-15(7-3)13-20-16(18)11-9-12-17(19)21-14(4)6-2/h6,14-15H,2,5,7-13H2,1,3-4H3 |
| InChIKey | MGJJVUJFODGCPL-UHFFFAOYSA-N |
| Mol Weight | 298.42 g/mol |
| Molecular Formula | C17H30O4 |
| Exact Mass | 298.214409 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 | 2BANtFLvzpW |
|---|---|
| Name | Glutaric acid, but-3-en-2-yl 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.214409442 u |
| Formula | C17H30O4 |
| InChI | InChI=1S/C17H30O4/c1-5-8-10-15(7-3)13-20-16(18)11-9-12-17(19)21-14(4)6-2/h6,14-15H,2,5,7-13H2,1,3-4H3 |
| InChIKey | MGJJVUJFODGCPL-UHFFFAOYSA-N |
| SMILES | C(CCC(OCC(CC)CCCC)=O)C(OC(C)C=C)=O |