![1-Chloranyl-2-[2,2,2-tris(fluoranyl)ethyl]benzene](/api/spectrum/23z3vyV0Lne/structure.png?h=300&w=458 "1-Chloranyl-2-[2,2,2-tris(fluoranyl)ethyl]benzene")
| SpectraBase Compound ID | 6PR4kSp81oL |
|---|---|
| InChI | InChI=1S/C8H6ClF3/c9-7-4-2-1-3-6(7)5-8(10,11)12/h1-4H,5H2 |
| InChIKey | WGQGWJIUZVXRKN-UHFFFAOYSA-N |
| Mol Weight | 194.58 g/mol |
| Molecular Formula | C8H6ClF3 |
| Exact Mass | 194.011012 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 23z3vyV0Lne |
|---|---|
| Name | 1-Chloranyl-2-[2,2,2-tris(fluoranyl)ethyl]benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.011012382 u |
| Formula | C8H6ClF3 |
| InChI | InChI=1S/C8H6ClF3/c9-7-4-2-1-3-6(7)5-8(10,11)12/h1-4H,5H2 |
| InChIKey | WGQGWJIUZVXRKN-UHFFFAOYSA-N |
| Molecular Weight | 194.584 g/mol |
| SMILES | C=1(C(=CC=CC1)CC(F)(F)F)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91959 |