| SpectraBase Compound ID | 1kLS0MlS378 |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-3-4-12-21-16(18)6-5-7-17(19)22-13-14-8-10-15(20-2)11-9-14/h8-11H,3-7,12-13H2,1-2H3 |
| InChIKey | OYCYOSDEXXMCLB-UHFFFAOYSA-N |
| Mol Weight | 308.37 g/mol |
| Molecular Formula | C17H24O5 |
| Exact Mass | 308.162374 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E1lc2Z2eIzk |
|---|---|
| Name | Glutaric acid, butyl 4-methoxybenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.162373868 u |
| Formula | C17H24O5 |
| InChI | InChI=1S/C17H24O5/c1-3-4-12-21-16(18)6-5-7-17(19)22-13-14-8-10-15(20-2)11-9-14/h8-11H,3-7,12-13H2,1-2H3 |
| InChIKey | OYCYOSDEXXMCLB-UHFFFAOYSA-N |
| SMILES | CCCCOC(CCCC(OCC1=CC=C(C=C1)OC)=O)=O |