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1-Bromo-4-(trifluoromethylthio)benzene
SpectraBase Compound ID CTLKQMOAHMv
InChI InChI=1S/C7H4BrF3S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChIKey CQQBVMXLTBXNLB-UHFFFAOYSA-N
Mol Weight 257.07 g/mol
Molecular Formula C7H4BrF3S
Exact Mass 255.916919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3eqAn4kePY
Name 1-bromo-4-[(trilfluoromethyl)thio]benzene
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.916918792 u
Formula C7H4BrF3S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C7H4BrF3S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChIKey CQQBVMXLTBXNLB-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 257.068 g/mol
Quality 321
Reported Formula C7H4(79)BrF3S
SMILES C1=CC(=CC=C1SC(F)(F)F)Br
SPLASH splash10-0a4i-1590000000-36f571dfcf5c9699d707
Source of Spectrum QE-21-SM29-2m (DOI: 10.1002/chem.201503915)
Wiley ID 1907366