| SpectraBase Compound ID | 2PSVjwU3FhV |
|---|---|
| InChI | InChI=1S/C8H8BrF/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6H2 |
| InChIKey | FLRUNCJXOVYWDH-UHFFFAOYSA-N |
| Mol Weight | 203.05 g/mol |
| Molecular Formula | C8H8BrF |
| Exact Mass | 201.979341 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | LvxaBkamxxD |
|---|---|
| Name | Benzene, 1-(2-bromoethyl)-4-fluoro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.979341421 u |
| Formula | C8H8BrF |
| InChI | InChI=1S/C8H8BrF/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6H2 |
| InChIKey | FLRUNCJXOVYWDH-UHFFFAOYSA-N |
| Molecular Weight | 203.054 g/mol |
| SMILES | C1(=CC=C(C=C1)F)CCBr |
| Spectrum/Structure Validation Score (Raman) | 0.976146 |