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PERFLUORO-3-ISOPROPYL-4-METHYL-2-PENTENYLSULPHENECHLORIDE-2
SpectraBase Compound ID Iw7uMYmLue1
InChI InChI=1S/C9ClF17S/c10-28-2(5(13,14)15)1(3(11,6(16,17)18)7(19,20)21)4(12,8(22,23)24)9(25,26)27
InChIKey XFJCJOIJUWHEDG-UHFFFAOYSA-N
Mol Weight 498.58 g/mol
Molecular Formula C9ClF17S
Exact Mass 497.913778 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KuHIEoXefX0
Name PERFLUORO-3-ISOPROPYL-4-METHYL-2-PENTENYLSULPHENECHLORIDE-2
Comments CIS AND TRANS (CF3)2CF WERE ASSIGNED EXACTLY. SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9ClF17S
InChI InChI=1S/C9ClF17S/c10-28-2(5(13,14)15)1(3(11,6(16,17)18)7(19,20)21)4(12,8(22,23)24)9(25,26)27
InChIKey XFJCJOIJUWHEDG-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.YA.POPKOVA, V.F.SNEGIREV, M.YU.ANTIPIN, YU.T.STRUCHKOV (1989) Izv.Akad.NaukSSSR(Russ. Lang.): N5, 1123-1129.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported