| SpectraBase Compound ID | 7pPWAsgfhOm |
|---|---|
| InChI | InChI=1S/C14H23Cl3O4/c1-3-5-6-11(4-2)9-20-12(18)7-8-13(19)21-10-14(15,16)17/h11H,3-10H2,1-2H3 |
| InChIKey | XYMVHQUJLLKAES-UHFFFAOYSA-N |
| Mol Weight | 361.69 g/mol |
| Molecular Formula | C14H23Cl3O4 |
| Exact Mass | 360.066192 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3fKLHDKvQ8V |
|---|---|
| Name | Succinic acid, 2-ethylhexyl 2,2,2-trichloroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.066192317 u |
| Formula | C14H23Cl3O4 |
| InChI | InChI=1S/C14H23Cl3O4/c1-3-5-6-11(4-2)9-20-12(18)7-8-13(19)21-10-14(15,16)17/h11H,3-10H2,1-2H3 |
| InChIKey | XYMVHQUJLLKAES-UHFFFAOYSA-N |
| Molecular Weight | 361.693 g/mol |
| SMILES | C(CC(OCC(CC)CCCC)=O)C(OCC(Cl)(Cl)Cl)=O |