| SpectraBase Compound ID | Kf06oINYO4z |
|---|---|
| InChI | InChI=1S/C8H12Cl2O4/c1-2-13-7(11)3-4-8(12)14-5-6(9)10/h6H,2-5H2,1H3 |
| InChIKey | PFNFXPLZQOXXMK-UHFFFAOYSA-N |
| Mol Weight | 243.09 g/mol |
| Molecular Formula | C8H12Cl2O4 |
| Exact Mass | 242.011264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FNj7RVSlOcc |
|---|---|
| Name | Succinic acid, 2,2-dichloroethyl ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.011264262 u |
| Formula | C8H12Cl2O4 |
| InChI | InChI=1S/C8H12Cl2O4/c1-2-13-7(11)3-4-8(12)14-5-6(9)10/h6H,2-5H2,1H3 |
| InChIKey | PFNFXPLZQOXXMK-UHFFFAOYSA-N |
| Molecular Weight | 243.086 g/mol |
| SMILES | C(OCC(Cl)Cl)(CCC(OCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.92482 |