| SpectraBase Compound ID | CCQAi5L9F4l |
|---|---|
| InChI | InChI=1S/C12H18Cl2O4/c1-2-3-4-5-8-17-11(15)6-7-12(16)18-9-10(13)14/h3-4,10H,2,5-9H2,1H3/b4-3+ |
| InChIKey | HHTFMMFOZANOQM-ONEGZZNKSA-N |
| Mol Weight | 297.18 g/mol |
| Molecular Formula | C12H18Cl2O4 |
| Exact Mass | 296.058214 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2dQIzFAycOS |
|---|---|
| Name | Succinic acid, 2,2-dichloroethyl trans-hex-3-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/h3-4,10H,2,5-9H2,1H3/b4-3+ |
| InChIKey | HHTFMMFOZANOQM-ONEGZZNKSA-N |
| Molecular Weight | 297.178 g/mol |
| SMILES | C(CC(OCC(Cl)Cl)=O)C(OCC\C=C\CC)=O |