| SpectraBase Compound ID | KNZAnhdNKdg |
|---|---|
| InChI | InChI=1S/C7H4Cl4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,7H |
| InChIKey | VBPLROSJWVETJQ-UHFFFAOYSA-N |
| Mol Weight | 229.9 g/mol |
| Molecular Formula | C7H4Cl4 |
| Exact Mass | 227.906711 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2xxoS58sPLa |
|---|---|
| Name | 1,4-Dichloro-2-(dichloromethyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.906710929 u |
| Formula | C7H4Cl4 |
| InChI | InChI=1S/C7H4Cl4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,7H |
| InChIKey | VBPLROSJWVETJQ-UHFFFAOYSA-N |
| Molecular Weight | 229.921 g/mol |
| SMILES | C(Cl)(Cl)C1=C(C=CC(=C1)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961305 |