| SpectraBase Compound ID | 1cPVGcn1nE |
|---|---|
| InChI | InChI=1S/C8H6BrF2NO/c1-4(13)12-5-2-6(10)8(9)7(11)3-5/h2-3H,1H3,(H,12,13) |
| InChIKey | BMAYBWUHRDSJOJ-UHFFFAOYSA-N |
| Mol Weight | 250.04 g/mol |
| Molecular Formula | C8H6BrF2NO |
| Exact Mass | 248.960083 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CtYoCyeClG8 |
|---|---|
| Name | 4-Bromo-3,5-difluoroacetanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.960083142 u |
| Formula | C8H6BrF2NO |
| InChI | InChI=1S/C8H6BrF2NO/c1-4(13)12-5-2-6(10)8(9)7(11)3-5/h2-3H,1H3,(H,12,13) |
| InChIKey | BMAYBWUHRDSJOJ-UHFFFAOYSA-N |
| Molecular Weight | 250.043 g/mol |
| SMILES | C1(F)=C(C(=CC(=C1)NC(=O)C)F)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975578 |