| SpectraBase Compound ID | 6sIiBirn5sM |
|---|---|
| InChI | InChI=1S/C8H5F5/c9-6-3-1-5(2-4-6)8(12,13)7(10)11/h1-4,7H |
| InChIKey | ZBJGMNXBOFIOJL-UHFFFAOYSA-N |
| Mol Weight | 196.12 g/mol |
| Molecular Formula | C8H5F5 |
| Exact Mass | 196.031141 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BE18GmxUSfN |
|---|---|
| Name | 1-(4-Fluorophenyl)-1,1,2,2-tetrafluoroethane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.031140976 u |
| Formula | C8H5F5 |
| InChI | InChI=1S/C8H5F5/c9-6-3-1-5(2-4-6)8(12,13)7(10)11/h1-4,7H |
| InChIKey | ZBJGMNXBOFIOJL-UHFFFAOYSA-N |
| Molecular Weight | 196.120 g/mol |
| SMILES | C(C(F)F)(F)(F)C=1C=CC(=CC1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.892938 |