| SpectraBase Compound ID | HvWNk85BgJP |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-12(2)11-20-16(18)9-6-10-17(19)21-15-8-5-7-13(3)14(15)4/h5,7-8,12H,6,9-11H2,1-4H3 |
| InChIKey | RXVRMZLCIUESRK-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 | L3suPcaVYbL |
|---|---|
| Name | Glutaric acid, 2,3-dimethylphenyl isobutyl 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/c1-12(2)11-20-16(18)9-6-10-17(19)21-15-8-5-7-13(3)14(15)4/h5,7-8,12H,6,9-11H2,1-4H3 |
| InChIKey | RXVRMZLCIUESRK-UHFFFAOYSA-N |
| SMILES | CC(C)COC(CCCC(OC1=CC=CC(=C1C)C)=O)=O |