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PENTAKIS(TRIFLUOROMETHYLTHIO)ANILINE
SpectraBase Compound ID JvV8I7n26MW
InChI InChI=1S/C11H2F15NS5/c12-7(13,14)28-2-1(27)3(29-8(15,16)17)5(31-10(21,22)23)6(32-11(24,25)26)4(2)30-9(18,19)20/h27H2
InChIKey JYJAKNQNVRBCBX-UHFFFAOYSA-N
Mol Weight 593.4 g/mol
Molecular Formula C11H2F15NS5
Exact Mass 592.855127 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CMBXqBWSMcu
Name PENTAKIS(TRIFLUOROMETHYLTHIO)ANILINE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H2F15NS5
InChI InChI=1S/C11H2F15NS5/c12-7(13,14)28-2-1(27)3(29-8(15,16)17)5(31-10(21,22)23)6(32-11(24,25)26)4(2)30-9(18,19)20/h27H2
InChIKey JYJAKNQNVRBCBX-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference L.M.YAGUPOL'SKY, A.A.KOLOMEITSEV, N.V.KONDRATENKO, V.I.POPOV, N.V.IGNAT'EV(1986) Zhurn.Org.Khim.(Russ. Lang.): v.22, N12, 2559-2563.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone