| SpectraBase Compound ID | 471yDAOyB7e |
|---|---|
| InChI | InChI=1S/C11H17Cl3O4/c1-2-17-9(15)6-4-3-5-7-10(16)18-8-11(12,13)14/h2-8H2,1H3 |
| InChIKey | PBQGDSVYUPGEPU-UHFFFAOYSA-N |
| Mol Weight | 319.61 g/mol |
| Molecular Formula | C11H17Cl3O4 |
| Exact Mass | 318.019242 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7h86EzDjkYZ |
|---|---|
| Name | Pimelic acid, 2,2,2-trichloroethyl ethyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H17Cl3O4 |
| InChI | InChI=1S/C11H17Cl3O4/c1-2-17-9(15)6-4-3-5-7-10(16)18-8-11(12,13)14/h2-8H2,1H3 |
| InChIKey | PBQGDSVYUPGEPU-UHFFFAOYSA-N |
| Molecular Weight | 319.612 g/mol |
| SMILES | C(CCCCCC(OCC(Cl)(Cl)Cl)=O)(OCC)=O |
| SPLASH | splash10-05y0-9400000000-78b65a8e7d4b0a557625 |
| Source of Spectrum | TIPS-2022-762-0 |
| Wiley ID | 1822279 |