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3-[4'-(2,3-DIHYDROXYPROPYLOXY)-3,3'-BIS-(1H,1H,2H,2H,3H,3H-PERFLUOROISODECYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
SpectraBase Compound ID 7W5AAho9w2y
InChI InChI=1S/C38H32F30O6/c39-25(40,29(45,46)33(53,54)31(49,50)27(43,35(57,58)59)36(60,61)62)9-1-3-19-11-17(5-7-23(19)73-15-21(71)13-69)18-6-8-24(74-16-22(72)14-70)20(12-18)4-2-10-26(41,42)30(47,48)34(55,56)32(51,52)28(44,37(63,64)65)38(66,67)68/h5-8,11-12,21-22,69-72H,1-4,9-10,13-16H2
InChIKey YLNVZMFYVPGSLT-UHFFFAOYSA-N
Mol Weight 1154.6 g/mol
Molecular Formula C38H32F30O6
Exact Mass 1154.171984 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Xm85NGmTKf
Name 3-[4'-(2,3-DIHYDROXYPROPYLOXY)-3,3'-BIS-(1H,1H,2H,2H,3H,3H-PERFLUOROISODECYL)-BIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
Compound Number 7/I7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H32F30O6
InChI InChI=1S/C38H32F30O6/c39-25(40,29(45,46)33(53,54)31(49,50)27(43,35(57,58)59)36(60,61)62)9-1-3-19-11-17(5-7-23(19)73-15-21(71)13-69)18-6-8-24(74-16-22(72)14-70)20(12-18)4-2-10-26(41,42)30(47,48)34(55,56)32(51,52)28(44,37(63,64)65)38(66,67)68/h5-8,11-12,21-22,69-72H,1-4,9-10,13-16H2
InChIKey YLNVZMFYVPGSLT-UHFFFAOYSA-N
Literature Reference Author X.CHENG,M.PREHM,M.K.DAS,J.KAIN,U.BAUMEISTER,S.DIELE,D.LEINE, A.BLUME,C.TSCHIERSKE
Literature Reference Citation J.AM.CHEM.SOC.,125,10977(2003)
Literature Reference DOI 10.1021/ja036213g
Solvent DMSO-D6
Source File Reference UWLU50712