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ETHYL 4-PHENYL-6-PENTAFLUOROPHENYLCYCLOHEXAN-2-ON-4-OL-1-CARBOXYLATE
SpectraBase Compound ID IbyKbYTFtsv
InChI InChI=1S/C21H17F5O4/c1-2-30-20(28)13-11(14-15(22)17(24)19(26)18(25)16(14)23)8-21(29,9-12(13)27)10-6-4-3-5-7-10/h3-7,11,13,29H,2,8-9H2,1H3
InChIKey IVROFZOOZIGCRA-UHFFFAOYSA-N
Mol Weight 428.36 g/mol
Molecular Formula C21H17F5O4
Exact Mass 428.1047 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BG45NMKWsvO
Name ETHYL 4-PHENYL-6-PENTAFLUOROPHENYLCYCLOHEXAN-2-ON-4-OL-1-CARBOXYLATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H17F5O4
InChI InChI=1S/C21H17F5O4/c1-2-30-20(28)13-11(14-15(22)17(24)19(26)18(25)16(14)23)8-21(29,9-12(13)27)10-6-4-3-5-7-10/h3-7,11,13,29H,2,8-9H2,1H3
InChIKey IVROFZOOZIGCRA-UHFFFAOYSA-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 CDCl3 chloroform-d