| SpectraBase Compound ID | HtCar2o4eGI |
|---|---|
| InChI | InChI=1S/C8H3Cl2F3/c9-4-1-2-6(10)5(3-4)7(11)8(12)13/h1-3H |
| InChIKey | JYTZHKUYVWDRHT-UHFFFAOYSA-N |
| Mol Weight | 227.01 g/mol |
| Molecular Formula | C8H3Cl2F3 |
| Exact Mass | 225.95639 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FJixkv1wgVr |
|---|---|
| Name | Benzene, 1,4-dichloro-2-(trifluoroethenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.956389986 u |
| Formula | C8H3Cl2F3 |
| InChI | InChI=1S/C8H3Cl2F3/c9-4-1-2-6(10)5(3-4)7(11)8(12)13/h1-3H |
| InChIKey | JYTZHKUYVWDRHT-UHFFFAOYSA-N |
| Molecular Weight | 227.013 g/mol |
| SMILES | C=1(C(=C(F)F)F)C(=CC=C(C1)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936139 |