| SpectraBase Compound ID | B15pw3kQORg |
|---|---|
| InChI | InChI=1S/C20H30O5/c1-3-14-24-19(21)10-7-11-20(22)25-16-13-18(12-15-23-2)17-8-5-4-6-9-17/h4-6,8-9,18H,3,7,10-16H2,1-2H3 |
| InChIKey | JYMZUZJYEGZSOJ-UHFFFAOYSA-N |
| Mol Weight | 350.46 g/mol |
| Molecular Formula | C20H30O5 |
| Exact Mass | 350.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7FO96CnV012 |
|---|---|
| Name | Glutaric acid, 5-methoxy-3-phenylpentyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.209324061 u |
| Formula | C20H30O5 |
| InChI | InChI=1S/C20H30O5/c1-3-14-24-19(21)10-7-11-20(22)25-16-13-18(12-15-23-2)17-8-5-4-6-9-17/h4-6,8-9,18H,3,7,10-16H2,1-2H3 |
| InChIKey | JYMZUZJYEGZSOJ-UHFFFAOYSA-N |
| Molecular Weight | 350.455 g/mol |
| SMILES | COCCC(CCOC(CCCC(OCCC)=O)=O)C1=CC=CC=C1 |