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2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-ICOSAFLUOROUNDECYL-2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSIDE

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2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-ICOSAFLUOROUNDECYL-2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 5P5jPPOGTrg
InChI InChI=1S/C45H38F20O6/c46-36(47)38(50,51)40(54,55)42(58,59)44(62,63)45(64,65)43(60,61)41(56,57)39(52,53)37(48,49)26-70-35-34(69-24-30-19-11-4-12-20-30)33(68-23-29-17-9-3-10-18-29)32(67-22-28-15-7-2-8-16-28)31(71-35)25-66-21-27-13-5-1-6-14-27/h1-20,31-36H,21-26H2/t31-,32-,33+,34-,35+/m1/s1
InChIKey NMIOGCRGLVVUBR-KJQSSVQNSA-N
Mol Weight 1054.8 g/mol
Molecular Formula C45H38F20O6
Exact Mass 1054.234902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KWGJS19x5m9
Name 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-ICOSAFLUOROUNDECYL-2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H38F20O6
InChI InChI=1S/C45H38F20O6/c46-36(47)38(50,51)40(54,55)42(58,59)44(62,63)45(64,65)43(60,61)41(56,57)39(52,53)37(48,49)26-70-35-34(69-24-30-19-11-4-12-20-30)33(68-23-29-17-9-3-10-18-29)32(67-22-28-15-7-2-8-16-28)31(71-35)25-66-21-27-13-5-1-6-14-27/h1-20,31-36H,21-26H2/t31-,32-,33+,34-,35+/m1/s1
InChIKey NMIOGCRGLVVUBR-KJQSSVQNSA-N
Literature Reference Author K.BRINER,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,75,621(1992)
Literature Reference DOI 10.1002/hlca.19920750218
Molecular Weight 1054.761 g/mol
Solvent CDCl3
Source File Reference UWCS6132