| SpectraBase Compound ID | 1b5daTNdt69 |
|---|---|
| InChI | InChI=1S/C17H24O4/c1-2-3-13-20-16(18)10-7-11-17(19)21-14-12-15-8-5-4-6-9-15/h4-6,8-9H,2-3,7,10-14H2,1H3 |
| InChIKey | FRIJEURAHRHNRJ-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 | KQfkgWfyT7 |
|---|---|
| Name | Glutaric acid, butyl phenethyl 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/c1-2-3-13-20-16(18)10-7-11-17(19)21-14-12-15-8-5-4-6-9-15/h4-6,8-9H,2-3,7,10-14H2,1H3 |
| InChIKey | FRIJEURAHRHNRJ-UHFFFAOYSA-N |
| SMILES | CCCCOC(CCCC(OCCC1=CC=CC=C1)=O)=O |