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[1,1'-biphenyl]-4-yl(trifluoromethyl)sulfane
SpectraBase Compound ID KjXmBp5eSXQ
InChI InChI=1S/C13H9F3S/c14-13(15,16)17-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKey SEPQBZDCWHISRJ-UHFFFAOYSA-N
Mol Weight 254.27 g/mol
Molecular Formula C13H9F3S
Exact Mass 254.037706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FeLATO9cGEu
Name 4-[(trifluoromethyl)thio]biphenyl
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.037705953 u
Formula C13H9F3S
InChI InChI=1S/C13H9F3S/c14-13(15,16)17-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKey SEPQBZDCWHISRJ-UHFFFAOYSA-N
Instrument Name Varian Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503524
Molecular Weight 254.270 g/mol
Quality 191
Reported Formula C13H9F3S
SMILES C1(SC(F)(F)F)=CC=C(C=C1)C1=CC=CC=C1
SPLASH splash10-0udr-1790000000-de6919174f37b857437e
Source of Spectrum QE-22-SM8-3g (DOI: 10.1002/chem.201503524)
Wiley ID 1902943