| SpectraBase Compound ID | LzqpaeJZMb |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-4-5-11-20-16(18)7-6-8-17(19)21-15-10-9-13(2)14(3)12-15/h9-10,12H,4-8,11H2,1-3H3 |
| InChIKey | YPQPYECVWCPIGA-UHFFFAOYSA-N |
| Mol Weight | 292.38 g/mol |
| Molecular Formula | C17H24O4 |
| Exact Mass | 292.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5BrdHp9kRL |
|---|---|
| Name | Glutaric acid, butyl 3,4-dimethylphenyl 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/c1-4-5-11-20-16(18)7-6-8-17(19)21-15-10-9-13(2)14(3)12-15/h9-10,12H,4-8,11H2,1-3H3 |
| InChIKey | YPQPYECVWCPIGA-UHFFFAOYSA-N |
| SMILES | CCCCOC(CCCC(OC1=CC=C(C(=C1)C)C)=O)=O |