| SpectraBase Compound ID | HwqyNnJveyR |
|---|---|
| InChI | InChI=1S/C8H12Cl2O4/c9-3-1-7(11)13-5-6-14-8(12)2-4-10/h1-6H2 |
| InChIKey | BYAAJQODLNAQQQ-UHFFFAOYSA-N |
| Mol Weight | 243.09 g/mol |
| Molecular Formula | C8H12Cl2O4 |
| Exact Mass | 242.011264 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HvHnzfXzXpK |
|---|---|
| Name | Ethylene glycol, bis(3-chloropropionate) |
| 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/c9-3-1-7(11)13-5-6-14-8(12)2-4-10/h1-6H2 |
| InChIKey | BYAAJQODLNAQQQ-UHFFFAOYSA-N |
| Molecular Weight | 243.086 g/mol |
| SMILES | C(Cl)CC(OCCOC(CCCl)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.95672 |