| SpectraBase Compound ID | 8yAuu5OND72 |
|---|---|
| InChI | InChI=1S/C3H3Cl3O2/c4-2(5)1-8-3(6)7/h2H,1H2 |
| InChIKey | LNGQDBJPFPIRBF-UHFFFAOYSA-N |
| Mol Weight | 177.41 g/mol |
| Molecular Formula | C3H3Cl3O2 |
| Exact Mass | 175.919862 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5gE8gDKp4Ii |
|---|---|
| Name | 2,2-Dichloroethyl chloroformate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.919862435 u |
| Formula | C3H3Cl3O2 |
| InChI | InChI=1S/C3H3Cl3O2/c4-2(5)1-8-3(6)7/h2H,1H2 |
| InChIKey | LNGQDBJPFPIRBF-UHFFFAOYSA-N |
| SMILES | C(Cl)(COC(Cl)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914733 |