| SpectraBase Compound ID | 48FbjoEjV2c |
|---|---|
| InChI | InChI=1S/C6HBrCl2F2/c7-2-1-3(10)5(9)6(11)4(2)8/h1H |
| InChIKey | JMZSSKGAWNYCOL-UHFFFAOYSA-N |
| Mol Weight | 261.88 g/mol |
| Molecular Formula | C6HBrCl2F2 |
| Exact Mass | 259.860675 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CCuRJGZejzS |
|---|---|
| Name | 1-Bromo-2,4-dichloro-3,5-difluorobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.860674758 u |
| Formula | C6HBrCl2F2 |
| InChI | InChI=1S/C6HBrCl2F2/c7-2-1-3(10)5(9)6(11)4(2)8/h1H |
| InChIKey | JMZSSKGAWNYCOL-UHFFFAOYSA-N |
| Molecular Weight | 261.881 g/mol |
| SMILES | C1(=C(C(=C(C(=C1)F)Cl)F)Cl)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.878 |