| SpectraBase Compound ID | 7bvkwWjxd52 |
|---|---|
| InChI | InChI=1S/C23H36O5/c1-4-5-6-7-8-9-11-19(2)28-23(25)13-10-12-22(24)27-18-20-14-16-21(26-3)17-15-20/h14-17,19H,4-13,18H2,1-3H3 |
| InChIKey | SVOWKKYSOATXGB-UHFFFAOYSA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C23H36O5 |
| Exact Mass | 392.256274 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AxmFOE8fit4 |
|---|---|
| Name | Glutaric acid, dec-2-yl 4-methoxybenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.256274254 u |
| Formula | C23H36O5 |
| InChI | InChI=1S/C23H36O5/c1-4-5-6-7-8-9-11-19(2)28-23(25)13-10-12-22(24)27-18-20-14-16-21(26-3)17-15-20/h14-17,19H,4-13,18H2,1-3H3 |
| InChIKey | SVOWKKYSOATXGB-UHFFFAOYSA-N |
| Molecular Weight | 392.536 g/mol |
| SMILES | C(CCC(OC(CCCCCCCC)C)=O)C(OCC1=CC=C(C=C1)OC)=O |