| SpectraBase Compound ID | ELhRVI7QlwI |
|---|---|
| InChI | InChI=1S/C15H26Cl2O4/c1-3-5-6-8-12(4-2)21-15(19)10-7-9-14(18)20-11-13(16)17/h12-13H,3-11H2,1-2H3 |
| InChIKey | RVDFZWLRIKPDNC-UHFFFAOYSA-N |
| Mol Weight | 341.28 g/mol |
| Molecular Formula | C15H26Cl2O4 |
| Exact Mass | 340.120815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bwqe8aaRotf |
|---|---|
| Name | Glutaric acid, 2,2-dichloroethyl 3-octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.120814713 u |
| Formula | C15H26Cl2O4 |
| InChI | InChI=1S/C15H26Cl2O4/c1-3-5-6-8-12(4-2)21-15(19)10-7-9-14(18)20-11-13(16)17/h12-13H,3-11H2,1-2H3 |
| InChIKey | RVDFZWLRIKPDNC-UHFFFAOYSA-N |
| Molecular Weight | 341.275 g/mol |
| SMILES | C(CCC(OCC(Cl)Cl)=O)C(OC(CCCCC)CC)=O |