SpectraBase Compound ID | Af3GP5xiSeB |
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InChI | InChI=1S/C4H8BrF/c1-2-4(6)3-5/h4H,2-3H2,1H3 |
InChIKey | BMJVYLYFMNOKCF-UHFFFAOYSA-N |
Mol Weight | 155.01 g/mol |
Molecular Formula | C4H8BrF |
Exact Mass | 153.979341 g/mol |
SpectraBase Spectrum ID | 92nGcT6MuuN |
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Name | 1-Bromo-2-fluorobutane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 153.979341421 u |
Formula | C4H8BrF |
InChI | InChI=1S/C4H8BrF/c1-2-4(6)3-5/h4H,2-3H2,1H3 |
InChIKey | BMJVYLYFMNOKCF-UHFFFAOYSA-N |
Molecular Weight | 155.010 g/mol |
SMILES | C(F)(CBr)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908853 |