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

View entire compound with spectra: 1 NMR

[4-3,4-4-(3)]-12G1-CH2OH;4-[4'-[4''-[3''',4'''-BIS-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLALCOHOL
SpectraBase Compound ID LXASTptqDok
InChI InChI=1S/C66H86O8/c1-3-5-7-9-11-13-15-17-19-21-45-68-60-36-25-57(26-37-60)51-73-65-44-33-59(47-66(65)74-52-58-27-38-61(39-28-58)69-46-22-20-18-16-14-12-10-8-6-4-2)53-72-64-42-31-56(32-43-64)50-71-63-40-29-55(30-41-63)49-70-62-34-23-54(48-67)24-35-62/h23-44,47,67H,3-22,45-46,48-53H2,1-2H3
InChIKey FCGKBURWCQALHH-UHFFFAOYSA-N
Mol Weight 1007.4 g/mol
Molecular Formula C66H86O8
Exact Mass 1006.63227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A2KbcdvvkZp
Name [4-3,4-4-(3)]-12G1-CH2OH;4-[4'-[4''-[3''',4'''-BIS-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZYLALCOHOL
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H86O8
InChI InChI=1S/C66H86O8/c1-3-5-7-9-11-13-15-17-19-21-45-68-60-36-25-57(26-37-60)51-73-65-44-33-59(47-66(65)74-52-58-27-38-61(39-28-58)69-46-22-20-18-16-14-12-10-8-6-4-2)53-72-64-42-31-56(32-43-64)50-71-63-40-29-55(30-41-63)49-70-62-34-23-54(48-67)24-35-62/h23-44,47,67H,3-22,45-46,48-53H2,1-2H3
InChIKey FCGKBURWCQALHH-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 1007.404 g/mol
Sample ID 33207
Solvent CDCl3