| SpectraBase Compound ID | 9eApiEBY6sg |
|---|---|
| InChI | InChI=1S/C15H26Cl2O4/c1-2-3-4-8-11-20-14(18)9-6-5-7-10-15(19)21-12-13(16)17/h13H,2-12H2,1H3 |
| InChIKey | BDNPTMCQDUDGMU-UHFFFAOYSA-N |
| Mol Weight | 341.28 g/mol |
| Molecular Formula | C15H26Cl2O4 |
| Exact Mass | 340.120815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2Do9rH83AO |
|---|---|
| Name | Pimelic acid, 2,2-dichloroethyl hexyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H26Cl2O4 |
| InChI | InChI=1S/C15H26Cl2O4/c1-2-3-4-8-11-20-14(18)9-6-5-7-10-15(19)21-12-13(16)17/h13H,2-12H2,1H3 |
| InChIKey | BDNPTMCQDUDGMU-UHFFFAOYSA-N |
| Molecular Weight | 341.275 g/mol |
| SMILES | C(CCCCCC(OCC(Cl)Cl)=O)(OCCCCCC)=O |
| SPLASH | splash10-054o-9510000000-fa3d34982ca98fdc9812 |
| Source of Spectrum | TIPS-2022-896-0 |
| Wiley ID | 1822413 |