[4-(2)-3,4-4-(3)]-12G1-CH2OH;4-[4'-[4''-[3''',4'''-BIS-[4''''-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-B

SpectraBase Compound ID	Ct6Rt7ot5tX
InChI	InChI=1S/C80H98O10/c1-3-5-7-9-11-13-15-17-19-21-53-82-72-40-25-65(26-41-72)57-85-76-48-33-69(34-49-76)61-89-79-52-37-71(63-88-78-46-31-68(32-47-78)60-87-75-44-29-67(30-45-75)59-84-74-38-23-64(56-81)24-39-74)55-80(79)90-62-70-35-50-77(51-36-70)86-58-66-27-42-73(43-28-66)83-54-22-20-18-16-14-12-10-8-6-4-2/h23-52,55,81H,3-22,53-54,56-63H2,1-2H3
InChIKey	ULXGMHJZZXVGNS-UHFFFAOYSA-N Google Search
Mol Weight	1219.7 g/mol
Molecular Formula	C80H98O10
Exact Mass	1218.715999 g/mol

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SpectraBase Spectrum ID	H1c8xdHMHcl
Name	[4-(2)-3,4-4-(3)]-12G1-CH2OH;4-[4'-[4''-[3''',4'''-BIS-[4''''-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-B
Compound Number	22
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C80H98O10
InChI	InChI=1S/C80H98O10/c1-3-5-7-9-11-13-15-17-19-21-53-82-72-40-25-65(26-41-72)57-85-76-48-33-69(34-49-76)61-89-79-52-37-71(63-88-78-46-31-68(32-47-78)60-87-75-44-29-67(30-45-75)59-84-74-38-23-64(56-81)24-39-74)55-80(79)90-62-70-35-50-77(51-36-70)86-58-66-27-42-73(43-28-66)83-54-22-20-18-16-14-12-10-8-6-4-2/h23-52,55,81H,3-22,53-54,56-63H2,1-2H3
InChIKey	ULXGMHJZZXVGNS-UHFFFAOYSA-N
Literature Reference Author	V.PERCEC,C.M.MITCHELL,W.D.CHO,S.UCHIDA,M.GLODDE,G.UNGAR,X.ZE NG,Y.LIU,V.S.K.BALAG
Literature Reference Citation	J.AM.CHEM.SOC.,126,6078(2004)
Literature Reference DOI	10.1021/ja049846j
Molecular Weight	1219.652 g/mol
Sample ID	33215
Solvent	CDCl3