| SpectraBase Compound ID | CCuA5rzYyL7 |
|---|---|
| InChI | InChI=1S/C7H8Cl4O4/c8-4(9)2-14-6(12)1-7(13)15-3-5(10)11/h4-5H,1-3H2 |
| InChIKey | RYOQIENTSXLUNE-UHFFFAOYSA-N |
| Mol Weight | 297.9 g/mol |
| Molecular Formula | C7H8Cl4O4 |
| Exact Mass | 295.91767 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IYtLDKuRqHb |
|---|---|
| Name | Malonic acid, di(2,2-dichloroethyl) ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.917669534 u |
| Formula | C7H8Cl4O4 |
| InChI | InChI=1S/C7H8Cl4O4/c8-4(9)2-14-6(12)1-7(13)15-3-5(10)11/h4-5H,1-3H2 |
| InChIKey | RYOQIENTSXLUNE-UHFFFAOYSA-N |
| Molecular Weight | 297.949 g/mol |
| SMILES | C(OCC(Cl)Cl)(CC(OCC(Cl)Cl)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.983051 |