3-[4'-(2,3-DIHYDROXYPROPYLOXY)-3-(1H,1H,2H,2H,3H,3H-PERFLUORONONYL)-3'-METHYLBIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL

SpectraBase Compound ID	ra0oIDU769
InChI	InChI=1S/C28H29F13O6/c1-15-9-16(4-6-21(15)46-13-19(44)11-42)17-5-7-22(47-14-20(45)12-43)18(10-17)3-2-8-23(29,30)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)41/h4-7,9-10,19-20,42-45H,2-3,8,11-14H2,1H3
InChIKey	ZFOBBPGLWBPZON-UHFFFAOYSA-N Google Search
Mol Weight	708.51 g/mol
Molecular Formula	C28H29F13O6
Exact Mass	708.175655 g/mol

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SpectraBase Spectrum ID	JDPAZ5P9qNG
Name	3-[4'-(2,3-DIHYDROXYPROPYLOXY)-3-(1H,1H,2H,2H,3H,3H-PERFLUORONONYL)-3'-METHYLBIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
Compound Number	6/1
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C28H29F13O6
InChI	InChI=1S/C28H29F13O6/c1-15-9-16(4-6-21(15)46-13-19(44)11-42)17-5-7-22(47-14-20(45)12-43)18(10-17)3-2-8-23(29,30)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)41/h4-7,9-10,19-20,42-45H,2-3,8,11-14H2,1H3
InChIKey	ZFOBBPGLWBPZON-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	UWLU50713