| SpectraBase Compound ID | EyFdpE3cqbd |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-13(2)11-20-16(18)5-4-6-17(19)21-12-15-9-7-14(3)8-10-15/h7-10,13H,4-6,11-12H2,1-3H3 |
| InChIKey | GAPQYARLIBOHGY-UHFFFAOYSA-N |
| Mol Weight | 292.38 g/mol |
| Molecular Formula | C17H24O4 |
| Exact Mass | 292.167459 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 | HVeGG5p2156 |
|---|---|
| Name | Glutaric acid, isobutyl 4-methylbenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.167459249 u |
| Formula | C17H24O4 |
| InChI | InChI=1S/C17H24O4/c1-13(2)11-20-16(18)5-4-6-17(19)21-12-15-9-7-14(3)8-10-15/h7-10,13H,4-6,11-12H2,1-3H3 |
| InChIKey | GAPQYARLIBOHGY-UHFFFAOYSA-N |
| SMILES | C(OCC=1C=CC(=CC1)C)(=O)CCCC(OCC(C)C)=O |