| SpectraBase Compound ID | Hh8px34M4LJ |
|---|---|
| InChI | InChI=1S/C7HBr2F5/c8-7(9)1-2(10)4(12)6(14)5(13)3(1)11/h7H |
| InChIKey | SCGYCYOVWSMRBB-UHFFFAOYSA-N |
| Mol Weight | 339.89 g/mol |
| Molecular Formula | C7HBr2F5 |
| Exact Mass | 337.836517 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3PYpboz6D87 |
|---|---|
| Name | 1-(Dibromomethyl)-2,3,4,5,6-pentafluorobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.836516847 u |
| Formula | C7HBr2F5 |
| InChI | InChI=1S/C7HBr2F5/c8-7(9)1-2(10)4(12)6(14)5(13)3(1)11/h7H |
| InChIKey | SCGYCYOVWSMRBB-UHFFFAOYSA-N |
| Molecular Weight | 339.885 g/mol |
| SMILES | C1(=C(C(=C(C(=C1F)C(Br)Br)F)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926107 |