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5-EXO-PHENYLTHIO-6-ENDO-CHLORO-2,3-TETRAFLUOROBENZOBICYCLO[2.2.2]OCTENE
SpectraBase Compound ID IiZkBhtFXf4
InChI InChI=1S/C18H13ClF4S/c19-13-9-6-7-10(18(13)24-8-4-2-1-3-5-8)12-11(9)14(20)16(22)17(23)15(12)21/h1-5,9-10,13,18H,6-7H2/t9-,10+,13+,18+/m0/s1
InChIKey MRSOOEDQWACLSJ-ARLOJCJBSA-N
Mol Weight 372.81 g/mol
Molecular Formula C18H13ClF4S
Exact Mass 372.036262 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4vukbJA7Ts
Name 5-EXO-PHENYLTHIO-6-ENDO-CHLORO-2,3-TETRAFLUOROBENZOBICYCLO[2.2.2]OCTENE
Comments CARCAS STRUCTURE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H13ClF4S
InChI InChI=1S/C18H13ClF4S/c19-13-9-6-7-10(18(13)24-8-4-2-1-3-5-8)12-11(9)14(20)16(22)17(23)15(12)21/h1-5,9-10,13,18H,6-7H2/t9-,10+,13+,18+/m0/s1
InChIKey MRSOOEDQWACLSJ-ARLOJCJBSA-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 carbon tetrachl