| SpectraBase Compound ID | AtEOKDLpFl2 |
|---|---|
| InChI | InChI=1S/C17H32O4/c1-4-6-7-8-9-13-20-16(18)11-10-12-17(19)21-14-15(3)5-2/h15H,4-14H2,1-3H3 |
| InChIKey | MYQWYCQOHIEKQJ-UHFFFAOYSA-N |
| Mol Weight | 300.4 g/mol |
| Molecular Formula | C17H32O4 |
| Exact Mass | 300.23006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KMkpdO64aME |
|---|---|
| Name | Glutaric acid, heptyl 2-methylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.230059506 u |
| Formula | C17H32O4 |
| InChI | InChI=1S/C17H32O4/c1-4-6-7-8-9-13-20-16(18)11-10-12-17(19)21-14-15(3)5-2/h15H,4-14H2,1-3H3 |
| InChIKey | MYQWYCQOHIEKQJ-UHFFFAOYSA-N |
| SMILES | CCCCCCCOC(CCCC(OCC(CC)C)=O)=O |