| SpectraBase Compound ID | 7iEhHWNloCa |
|---|---|
| InChI | InChI=1S/C17H24O5/c1-3-4-12-21-16(18)10-7-11-17(19)22-13-14-8-5-6-9-15(14)20-2/h5-6,8-9H,3-4,7,10-13H2,1-2H3 |
| InChIKey | WJVBWJBIOCVQJY-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 | JxUKiciI0RX |
|---|---|
| Name | Glutaric acid, butyl 2-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)10-7-11-17(19)22-13-14-8-5-6-9-15(14)20-2/h5-6,8-9H,3-4,7,10-13H2,1-2H3 |
| InChIKey | WJVBWJBIOCVQJY-UHFFFAOYSA-N |
| SMILES | C(OCC=1C(OC)=CC=CC1)(=O)CCCC(OCCCC)=O |