| SpectraBase Compound ID | DYpywbuDVjM |
|---|---|
| InChI | InChI=1S/C3H4Cl2O/c4-1-3(5)2-6/h2-3H,1H2 |
| InChIKey | IZRKUJREXIKAQM-UHFFFAOYSA-N |
| Mol Weight | 126.97 g/mol |
| Molecular Formula | C3H4Cl2O |
| Exact Mass | 125.96392 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 67PQ1w9yL3a |
|---|---|
| Name | 2,3-Dichloropropanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 125.963920148 u |
| Formula | C3H4Cl2O |
| InChI | InChI=1S/C3H4Cl2O/c4-1-3(5)2-6/h2-3H,1H2 |
| InChIKey | IZRKUJREXIKAQM-UHFFFAOYSA-N |
| Molecular Weight | 126.970 g/mol |
| SMILES | C(=O)C(Cl)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.889267 |