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1-(3-Bromophenyl)-2,2,2-trifluoroethan-1-one
SpectraBase Compound ID CvAqfOJEORy
InChI InChI=1S/C8H4BrF3O/c9-6-3-1-2-5(4-6)7(13)8(10,11)12/h1-4H
InChIKey JOKNUXPHMQZTQB-UHFFFAOYSA-N
Mol Weight 253.02 g/mol
Molecular Formula C8H4BrF3O
Exact Mass 251.939762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTExqesdV3T
Name 1-(3-Bromophenyl)-2,2,2-trifluoroethan-1-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4BrF3O
InChI InChI=1S/C8H4BrF3O/c9-6-3-1-2-5(4-6)7(13)8(10,11)12/h1-4H
InChIKey JOKNUXPHMQZTQB-UHFFFAOYSA-N
Instrument Name JEOL JMS-Q1050GC-Agilent7890
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.17.39
Molecular Weight 253.018 g/mol
SMILES c1cc(cc(c1)C(C(F)(F)F)=O)Br
SPLASH splash10-0a5i-0900000000-dbb7b930b6351bb0a70e
Source of Spectrum BJO-17-SM9-2j
Wiley ID 1858455