| SpectraBase Compound ID | 6o3FvX8I4dD |
|---|---|
| InChI | InChI=1S/C15H26Cl2O4/c1-4-7-8-9-10-20-13(18)15(5-2,6-3)14(19)21-11-12(16)17/h12H,4-11H2,1-3H3 |
| InChIKey | DTOYZLQISNGCMX-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 | OyGz9kzBbH |
|---|---|
| Name | Diethylmalonic acid, 2,2-dichloroethyl hexyl 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/c1-4-7-8-9-10-20-13(18)15(5-2,6-3)14(19)21-11-12(16)17/h12H,4-11H2,1-3H3 |
| InChIKey | DTOYZLQISNGCMX-UHFFFAOYSA-N |
| Molecular Weight | 341.275 g/mol |
| SMILES | C(C(C(OCCCCCC)=O)(CC)CC)(OCC(Cl)Cl)=O |