SpectraBase Compound ID | 7eKZVPT154g |
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InChI | InChI=1S/C2H2BrClF2/c3-2(5,6)1-4/h1H2 |
InChIKey | FFSMSSWIZLKFLU-UHFFFAOYSA-N |
Mol Weight | 179.39 g/mol |
Molecular Formula | C2H2BrClF2 |
Exact Mass | 177.899647 g/mol |
SpectraBase Spectrum ID | 4L94wB45j6l |
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Name | 1-Bromo-2-chloro-1,1-difluoro-ethane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.899647090 u |
Formula | C2H2BrClF2 |
InChI | InChI=1S/C2H2BrClF2/c3-2(5,6)1-4/h1H2 |
InChIKey | FFSMSSWIZLKFLU-UHFFFAOYSA-N |
Molecular Weight | 179.392 g/mol |
SMILES | C(F)(F)(Br)CCl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.870272 |