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(rac)-2,3,4,5,6-Pentafluoro(4-phenylbutan-2-ylthio)benzene
SpectraBase Compound ID GTU5z9Wpbnj
InChI InChI=1S/C16H13F5S/c1-9(7-8-10-5-3-2-4-6-10)22-16-14(20)12(18)11(17)13(19)15(16)21/h2-6,9H,7-8H2,1H3
InChIKey CGHHIPSOPZMQIB-UHFFFAOYSA-N
Mol Weight 332.33 g/mol
Molecular Formula C16H13F5S
Exact Mass 332.065812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tlMMWPfp68
Name (rac)-2,3,4,5,6-Pentafluoro(4-phenylbutan-2-ylthio)benzene
Alternate Name(s) (perfluorophenyl)(4-phenylbutan-2-yl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13F5S
InChI InChI=1S/C16H13F5S/c1-9(7-8-10-5-3-2-4-6-10)22-16-14(20)12(18)11(17)13(19)15(16)21/h2-6,9H,7-8H2,1H3
InChIKey CGHHIPSOPZMQIB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402246h
Molecular Weight 332.332 g/mol
SMILES c1cc(CCC(C)Sc2c(c(c(c(c2F)F)F)F)F)ccc1
SPLASH splash10-0006-9100000000-f758ce719d68e2f5c206
Source of Spectrum J-78-12608-3c
Wiley ID 1747383