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3-[4'-HYDROXY-3-(1H,1H,2H,2H,3H,3H-PERFUOROHEPTYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
SpectraBase Compound ID FcJU0yswSa1
InChI InChI=1S/C22H21F9O4/c23-19(24,20(25,26)21(27,28)22(29,30)31)9-1-2-15-10-14(13-3-6-16(33)7-4-13)5-8-18(15)35-12-17(34)11-32/h3-8,10,17,32-34H,1-2,9,11-12H2
InChIKey MZIOFRBOTXYFLK-UHFFFAOYSA-N
Mol Weight 520.39 g/mol
Molecular Formula C22H21F9O4
Exact Mass 520.129613 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8mueUGsTTn3
Name 3-[4'-HYDROXY-3-(1H,1H,2H,2H,3H,3H-PERFUOROHEPTYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21F9O4
InChI InChI=1S/C22H21F9O4/c23-19(24,20(25,26)21(27,28)22(29,30)31)9-1-2-15-10-14(13-3-6-16(33)7-4-13)5-8-18(15)35-12-17(34)11-32/h3-8,10,17,32-34H,1-2,9,11-12H2
InChIKey MZIOFRBOTXYFLK-UHFFFAOYSA-N
Literature Reference Author X.CHENG,M.K.DAS,U.BAUMEISTER,S.DIELE,C.TSCHIERSKE
Literature Reference Citation J.AM.CHEM.SOC.,126,12930(2004)
Literature Reference DOI 10.1021/ja048224v
Solvent DMSO-D6
Source File Reference UWLU34723