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1-Fluoro-4-(trifluoromethylthio)benzene
SpectraBase Compound ID BLJ05Vs3ocN
InChI InChI=1S/C7H4F4S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChIKey BTKQCAUEXFTVNT-UHFFFAOYSA-N
Mol Weight 196.16 g/mol
Molecular Formula C7H4F4S
Exact Mass 195.996984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1OjSSfxrlI
Name 1-fluoro-4-[(trifluoromethyl)thio]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.996983955 u
Formula C7H4F4S
GC Column HP-5 (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C7H4F4S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChIKey BTKQCAUEXFTVNT-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503915
Molecular Weight 196.163 g/mol
Quality 342
Reported Formula C7H4F4S
SMILES C1=CC(=CC=C1SC(F)(F)F)F
SPLASH splash10-002b-5900000000-5125b92c3a2f56996cf2
Source of Spectrum QE-21-SM31-2o (DOI: 10.1002/chem.201503915)
Wiley ID 1907368