| SpectraBase Compound ID | D49SYNxdj1E |
|---|---|
| InChI | InChI=1S/C12H18Cl2O4/c1-2-3-4-5-8-17-11(15)6-7-12(16)18-9-10(13)14/h2,10H,1,3-9H2 |
| InChIKey | XTVYLAJSHRJWKH-UHFFFAOYSA-N |
| Mol Weight | 297.18 g/mol |
| Molecular Formula | C12H18Cl2O4 |
| Exact Mass | 296.058214 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 | 5UtT6Qe9sH3 |
|---|---|
| Name | Succinic acid, 2,2-dichloroethyl hex-5-en-1-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.058214456 u |
| Formula | C12H18Cl2O4 |
| InChI | InChI=1S/C12H18Cl2O4/c1-2-3-4-5-8-17-11(15)6-7-12(16)18-9-10(13)14/h2,10H,1,3-9H2 |
| InChIKey | XTVYLAJSHRJWKH-UHFFFAOYSA-N |
| Molecular Weight | 297.178 g/mol |
| SMILES | C(CC(OCC(Cl)Cl)=O)C(OCCCCC=C)=O |