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5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene

View entire compound with spectra: 1 FTIR

5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene
SpectraBase Compound ID 6dyjtF7jap9
InChI InChI=1S/C8H4BrF5O/c9-4-1-5(10)7(6(11)2-4)15-3-8(12,13)14/h1-2H,3H2
InChIKey PKBORPYIKXALHI-UHFFFAOYSA-N
Mol Weight 291.02 g/mol
Molecular Formula C8H4BrF5O
Exact Mass 289.936569 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2wGiUbE1MQw
Name 5-Bromo-1,3-difluoro-2-(2,2,2-trifluoroethoxy)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.936568563 u
Formula C8H4BrF5O
InChI InChI=1S/C8H4BrF5O/c9-4-1-5(10)7(6(11)2-4)15-3-8(12,13)14/h1-2H,3H2
InChIKey PKBORPYIKXALHI-UHFFFAOYSA-N
Molecular Weight 291.015 g/mol
SMILES C1(=C(C(=CC(=C1)Br)F)OCC(F)(F)F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.82783