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

SpectraBase Compound ID	3Xf1fF1KUDO
InChI	InChI=1S/C39H51F13O6/c1-2-3-4-5-6-7-8-9-10-11-13-28-20-26(15-17-32(28)57-24-30(55)22-53)27-16-18-33(58-25-31(56)23-54)29(21-27)14-12-19-34(40,41)35(42,43)36(44,45)37(46,47)38(48,49)39(50,51)52/h15-18,20-21,30-31,53-56H,2-14,19,22-25H2,1H3
InChIKey	WEYACMNVVJBYCC-UHFFFAOYSA-N Google Search
Mol Weight	862.8 g/mol
Molecular Formula	C39H51F13O6
Exact Mass	862.347805 g/mol

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SpectraBase Spectrum ID	HuhwhJdj5Uc
Name	3-[4'-(2,3-DIHYDROXYPROPYLOXY)-3-(1H,1H,2H,2H,3H,3H-PERFLUORONONYL)-3'-DODECYLBIPHENYL-4-YLOXY]-PROPANE-1,2-DIOL
Compound Number	6/12
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C39H51F13O6
InChI	InChI=1S/C39H51F13O6/c1-2-3-4-5-6-7-8-9-10-11-13-28-20-26(15-17-32(28)57-24-30(55)22-53)27-16-18-33(58-25-31(56)23-54)29(21-27)14-12-19-34(40,41)35(42,43)36(44,45)37(46,47)38(48,49)39(50,51)52/h15-18,20-21,30-31,53-56H,2-14,19,22-25H2,1H3
InChIKey	WEYACMNVVJBYCC-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	UWLU50715