| SpectraBase Compound ID | BY6BbTPKpYl |
|---|---|
| InChI | InChI=1S/C7H5BrF2/c8-7(9,10)6-4-2-1-3-5-6/h1-5H |
| InChIKey | RINSMVSYCNNAGC-UHFFFAOYSA-N |
| Mol Weight | 207.02 g/mol |
| Molecular Formula | C7H5BrF2 |
| Exact Mass | 205.954269 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6qFdr8M3ymh |
|---|---|
| Name | (Bromo-difluoromethyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.954269487 u |
| Formula | C7H5BrF2 |
| InChI | InChI=1S/C7H5BrF2/c8-7(9,10)6-4-2-1-3-5-6/h1-5H |
| InChIKey | RINSMVSYCNNAGC-UHFFFAOYSA-N |
| Molecular Weight | 207.018 g/mol |
| SMILES | C(F)(C=1C=CC=CC1)(F)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.869795 |