| SpectraBase Compound ID | H3c8wX2iNrl |
|---|---|
| InChI | InChI=1S/C3H4BrF3/c1-2(4)3(5,6)7/h2H,1H3 |
| InChIKey | WJFIVNWCJZUQMI-UHFFFAOYSA-N |
| Mol Weight | 176.96 g/mol |
| Molecular Formula | C3H4BrF3 |
| Exact Mass | 175.944848 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2ukxgMiXcDG |
|---|---|
| Name | 2-Bromanyl-1,1,1-tris(fluoranyl)propane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.944847618 u |
| Formula | C3H4BrF3 |
| InChI | InChI=1S/C3H4BrF3/c1-2(4)3(5,6)7/h2H,1H3 |
| InChIKey | WJFIVNWCJZUQMI-UHFFFAOYSA-N |
| Molecular Weight | 176.964 g/mol |
| SMILES | C(C(Br)C)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.867631 |