| SpectraBase Compound ID | JTnT8K52se8 |
|---|---|
| InChI | InChI=1S/C15H26Cl2O4/c1-2-11-20-14(18)9-7-5-3-4-6-8-10-15(19)21-12-13(16)17/h13H,2-12H2,1H3 |
| InChIKey | KPZNTXRWJPYAQO-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 | 3euZLNI2rhK |
|---|---|
| Name | Sebacic acid, 2,2-dichloroethyl propyl 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/c1-2-11-20-14(18)9-7-5-3-4-6-8-10-15(19)21-12-13(16)17/h13H,2-12H2,1H3 |
| InChIKey | KPZNTXRWJPYAQO-UHFFFAOYSA-N |
| Molecular Weight | 341.275 g/mol |
| SMILES | C(CCCCCCCCC(OCCC)=O)(OCC(Cl)Cl)=O |