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3-[4'-HYDROXY-3-(1H,1H,2H,2H,3H,3H-PERFUOROUNDECYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL

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3-[4'-HYDROXY-3-(1H,1H,2H,2H,3H,3H-PERFUOROUNDECYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
SpectraBase Compound ID 3SPagUEG3OT
InChI InChI=1S/C26H21F17O4/c27-19(28,20(29,30)21(31,32)22(33,34)23(35,36)24(37,38)25(39,40)26(41,42)43)9-1-2-15-10-14(13-3-6-16(45)7-4-13)5-8-18(15)47-12-17(46)11-44/h3-8,10,17,44-46H,1-2,9,11-12H2
InChIKey DHECFDXZIXUOFG-UHFFFAOYSA-N
Mol Weight 720.42 g/mol
Molecular Formula C26H21F17O4
Exact Mass 720.116838 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGR3ii3Jbxy
Name 3-[4'-HYDROXY-3-(1H,1H,2H,2H,3H,3H-PERFUOROUNDECYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H21F17O4
InChI InChI=1S/C26H21F17O4/c27-19(28,20(29,30)21(31,32)22(33,34)23(35,36)24(37,38)25(39,40)26(41,42)43)9-1-2-15-10-14(13-3-6-16(45)7-4-13)5-8-18(15)47-12-17(46)11-44/h3-8,10,17,44-46H,1-2,9,11-12H2
InChIKey DHECFDXZIXUOFG-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 UWLU34726