| SpectraBase Compound ID | 6lMrpshvXxp |
|---|---|
| InChI | InChI=1S/C8H6Br3F/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7H |
| InChIKey | SCURPZDGAVPATP-UHFFFAOYSA-N |
| Mol Weight | 360.85 g/mol |
| Molecular Formula | C8H6Br3F |
| Exact Mass | 357.800367 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 | 6eQbFF0xfDr |
|---|---|
| Name | 2,2,2-Tribromo-1-phenyl-1-fluoroethane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.800367356 u |
| Formula | C8H6Br3F |
| InChI | InChI=1S/C8H6Br3F/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7H |
| InChIKey | SCURPZDGAVPATP-UHFFFAOYSA-N |
| Molecular Weight | 360.846 g/mol |
| SMILES | C(C(C1=CC=CC=C1)F)(Br)(Br)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.81378 |