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2-PENTAFLUOROPHENYL-4-PHENYLBICYCLO[3.3.1]NON-3-EN-9-ONE
SpectraBase Compound ID Enw6pNnJBiv
InChI InChI=1S/C21H15F5O/c22-16-15(17(23)19(25)20(26)18(16)24)14-9-13(10-5-2-1-3-6-10)11-7-4-8-12(14)21(11)27/h1-3,5-6,9,11-12,14H,4,7-8H2/t11-,12+,14+/m1/s1
InChIKey CNDAULSBOJEHTQ-DYEKYZERSA-N
Mol Weight 378.34 g/mol
Molecular Formula C21H15F5O
Exact Mass 378.104306 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ie8FExTiBK4
Name 2-PENTAFLUOROPHENYL-4-PHENYLBICYCLO[3.3.1]NON-3-EN-9-ONE
Comments CARCAS STRUCTURE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H15F5O
InChI InChI=1S/C21H15F5O/c22-16-15(17(23)19(25)20(26)18(16)24)14-9-13(10-5-2-1-3-6-10)11-7-4-8-12(14)21(11)27/h1-3,5-6,9,11-12,14H,4,7-8H2/t11-,12+,14+/m1/s1
InChIKey CNDAULSBOJEHTQ-DYEKYZERSA-N
Instrument Name Varian A56/60A
Literature Reference N.A.ORLOVA, T.N.GERASIMOVA, M.A.KUDINOVA, A.I.TOLMACHEV (1990)Zhurn.Org.Khim.(Russ. Lang.): v.26, N6, 1313-1321.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H8O tetrahydrofura