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6-ENDO-HYDROXY-8-ENDO-(PARA-CHLOROPHENYL)THIO-3,4-TETRAFLUOROBENZOTRICYCLO[3.2.1.0(2,7)]OCTENE
SpectraBase Compound ID D72UpTwpr1R
InChI InChI=1S/C18H11ClF4OS/c19-5-1-3-6(4-2-5)25-18-11-7-8-9(12(18)17(24)10(7)11)14(21)16(23)15(22)13(8)20/h1-4,7,10-12,17-18,24H/t7-,10+,11-,12+,17+,18-/m1/s1
InChIKey LIRPODQPBVFJSV-BXUNZPEWSA-N
Mol Weight 386.79 g/mol
Molecular Formula C18H11ClF4OS
Exact Mass 386.015526 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DWl4vmhdUrI
Name 6-ENDO-HYDROXY-8-ENDO-(PARA-CHLOROPHENYL)THIO-3,4-TETRAFLUOROBENZOTRICYCLO[3.2.1.0(2,7)]OCTENE
Comments CARCAS STRUCTURE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H11ClF4OS
InChI InChI=1S/C18H11ClF4OS/c19-5-1-3-6(4-2-5)25-18-11-7-8-9(12(18)17(24)10(7)11)14(21)16(23)15(22)13(8)20/h1-4,7,10-12,17-18,24H/t7-,10+,11-,12+,17+,18-/m1/s1
InChIKey LIRPODQPBVFJSV-BXUNZPEWSA-N
Instrument Name Varian A56/60A
Literature Reference G.A.NISNEVICH, V.I.MAMATYUK, V.A.BARKHASH, T.N.VELIKOKHAT'KO, N.K.SADOVAYA,N.S.ZEFIROV, O.I.LYUBINSKAYA, G.S.MIKAELYAN, V.A.SMIT, E.YU.GRUDZINSKAYA,E.V.SKOROBOGATOVA, V.R.KARTASHOV, T.I.NOVIKOVA, I.V.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4/C3D6O