| SpectraBase Compound ID | IIwZzjXloDg |
|---|---|
| InChI | InChI=1S/C3H2BrF5/c4-1(5)3(8,9)2(6)7/h1-2H |
| InChIKey | YVCRODDOSXLACJ-UHFFFAOYSA-N |
| Mol Weight | 212.945 g/mol |
| Molecular Formula | C3H2BrF5 |
| Exact Mass | 211.926004 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | nfnxcAjNnE |
|---|---|
| Name | 1-Bromo-1,2,2,3,3-pentafluoropropane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.926003879 u |
| Formula | C3H2BrF5 |
| InChI | InChI=1S/C3H2BrF5/c4-1(5)3(8,9)2(6)7/h1-2H |
| InChIKey | YVCRODDOSXLACJ-UHFFFAOYSA-N |
| Molecular Weight | 212.945 g/mol |
| SMILES | C(F)(Br)C(C(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.875965 |