[4-3,4,5-4-(2)]-12G1-CO2CH3;METHYL-4-[4'-[3'',4'',5''-TRIS-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZOATE

SpectraBase Compound ID	5naHIkf6Q2F
InChI	InChI=1S/C79H110O10/c1-5-8-11-14-17-20-23-26-29-32-55-82-71-45-35-66(36-46-71)61-87-76-58-69(64-86-74-51-41-65(42-52-74)60-85-75-53-43-70(44-54-75)79(80)81-4)59-77(88-62-67-37-47-72(48-38-67)83-56-33-30-27-24-21-18-15-12-9-6-2)78(76)89-63-68-39-49-73(50-40-68)84-57-34-31-28-25-22-19-16-13-10-7-3/h35-54,58-59H,5-34,55-57,60-64H2,1-4H3
InChIKey	WDUKKCIRVAKEEQ-UHFFFAOYSA-N Google Search
Mol Weight	1219.7 g/mol
Molecular Formula	C79H110O10
Exact Mass	1218.8099 g/mol

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SpectraBase Spectrum ID	HrBkEqNm3rL
Name	[4-3,4,5-4-(2)]-12G1-CO2CH3;METHYL-4-[4'-[3'',4'',5''-TRIS-[PARA-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYLOXY]-BENZYLOXY]-BENZOATE
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C79H110O10
InChI	InChI=1S/C79H110O10/c1-5-8-11-14-17-20-23-26-29-32-55-82-71-45-35-66(36-46-71)61-87-76-58-69(64-86-74-51-41-65(42-52-74)60-85-75-53-43-70(44-54-75)79(80)81-4)59-77(88-62-67-37-47-72(48-38-67)83-56-33-30-27-24-21-18-15-12-9-6-2)78(76)89-63-68-39-49-73(50-40-68)84-57-34-31-28-25-22-19-16-13-10-7-3/h35-54,58-59H,5-34,55-57,60-64H2,1-4H3
InChIKey	WDUKKCIRVAKEEQ-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	1219.736 g/mol
Sample ID	33193
Solvent	CDCl3