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1-Bromo-4-(trifluoromethylthio)benzene

View entire compound with spectra: 1 NMR, 3 FTIR, 1 Raman, and 2 MS (GC)

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 5KGOovzvzEs
Name (4-bromophenyl)(trifluoromethyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4BrF3S
InChI InChI=1S/C7H4BrF3S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChIKey CQQBVMXLTBXNLB-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2013.10.028
Molecular Weight 257.068 g/mol
SMILES c1(ccc(cc1)SC(F)(F)F)Br
SPLASH splash10-0a4i-7920000000-01f29e4503d33fcfafbb
Source of Spectrum Lijuan Zhai, et al. Tetrahedron, 10.1016/j.tet.2013.10.028
Wiley ID 1817134