| SpectraBase Compound ID | 9zGzs6l6RSx |
|---|---|
| InChI | InChI=1S/C21H32O5/c1-4-5-6-7-8-9-11-17(2)25-20(22)14-15-21(23)26-19-13-10-12-18(16-19)24-3/h10,12-13,16-17H,4-9,11,14-15H2,1-3H3 |
| InChIKey | KBQZSXAFBDCWFL-UHFFFAOYSA-N |
| Mol Weight | 364.5 g/mol |
| Molecular Formula | C21H32O5 |
| Exact Mass | 364.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gp6jFR0uiD1 |
|---|---|
| Name | Succinic acid, dec-2-yl 3-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 364.224974125 u |
| Formula | C21H32O5 |
| InChI | InChI=1S/C21H32O5/c1-4-5-6-7-8-9-11-17(2)25-20(22)14-15-21(23)26-19-13-10-12-18(16-19)24-3/h10,12-13,16-17H,4-9,11,14-15H2,1-3H3 |
| InChIKey | KBQZSXAFBDCWFL-UHFFFAOYSA-N |
| Molecular Weight | 364.482 g/mol |
| SMILES | C(CC(OC(CCCCCCCC)C)=O)C(OC1=CC=CC(=C1)OC)=O |