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3,4-BIS-[3',4'-BIS-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYL-ALCOHOL
SpectraBase Compound ID 8hdFDn8Cr9N
InChI InChI=1S/C69H116O7/c1-5-9-13-17-21-25-29-33-37-41-51-71-64-49-46-62(56-67(64)73-53-43-39-35-31-27-23-19-15-11-7-3)59-75-66-48-45-61(58-70)55-69(66)76-60-63-47-50-65(72-52-42-38-34-30-26-22-18-14-10-6-2)68(57-63)74-54-44-40-36-32-28-24-20-16-12-8-4/h45-50,55-57,70H,5-44,51-54,58-60H2,1-4H3
InChIKey GQQSUGXLZMMASU-UHFFFAOYSA-N
Mol Weight 1057.7 g/mol
Molecular Formula C69H116O7
Exact Mass 1056.872106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I2neypXAKDH
Name 3,4-BIS-[3',4'-BIS-(N-DODECAN-1-YLOXY)-BENZYLOXY]-BENZYL-ALCOHOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C69H116O7
InChI InChI=1S/C69H116O7/c1-5-9-13-17-21-25-29-33-37-41-51-71-64-49-46-62(56-67(64)73-53-43-39-35-31-27-23-19-15-11-7-3)59-75-66-48-45-61(58-70)55-69(66)76-60-63-47-50-65(72-52-42-38-34-30-26-22-18-14-10-6-2)68(57-63)74-54-44-40-36-32-28-24-20-16-12-8-4/h45-50,55-57,70H,5-44,51-54,58-60H2,1-4H3
InChIKey GQQSUGXLZMMASU-UHFFFAOYSA-N
Literature Reference Author V.PERCEC,W.D.CHO,G.UNGAR,D.J.P.YEARDLEY
Literature Reference Citation J.AM.CHEM.SOC.,123,1302(2001)
Literature Reference DOI 10.1021/ja0037771
Molecular Weight 1057.676 g/mol
Solvent CDCl3
Source File Reference UWSI23524