| SpectraBase Compound ID | 779qwYVstGM |
|---|---|
| InChI | InChI=1S/C22H41ClO4/c1-3-4-5-6-9-12-15-20(2)27-22(25)17-16-21(24)26-19-14-11-8-7-10-13-18-23/h20H,3-19H2,1-2H3 |
| InChIKey | IKHVJILWQHTJFO-UHFFFAOYSA-N |
| Mol Weight | 405.0 g/mol |
| Molecular Formula | C22H41ClO4 |
| Exact Mass | 404.269337 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DyAqlJ0QyDg |
|---|---|
| Name | Succinic acid, dec-2-yl 8-chlorooctyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 404.269337496 u |
| Formula | C22H41ClO4 |
| InChI | InChI=1S/C22H41ClO4/c1-3-4-5-6-9-12-15-20(2)27-22(25)17-16-21(24)26-19-14-11-8-7-10-13-18-23/h20H,3-19H2,1-2H3 |
| InChIKey | IKHVJILWQHTJFO-UHFFFAOYSA-N |
| Molecular Weight | 405.019 g/mol |
| SMILES | C(CC(OC(CCCCCCCC)C)=O)C(OCCCCCCCCCl)=O |