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1,4-BIS-[(3,4-DI-O-BENZYL-1,2-O-ISOPROPYLIDENE-BETA-D-FRUCTOFURANOSE-6-O-YL)-METHYL]-BENZENE
SpectraBase Compound ID 7bVsIIixcbm
InChI InChI=1S/C54H62O12/c1-51(2)61-37-53(65-51)49(59-33-41-21-13-7-14-22-41)47(57-31-39-17-9-5-10-18-39)45(63-53)35-55-29-43-25-27-44(28-26-43)30-56-36-46-48(58-32-40-19-11-6-12-20-40)50(60-34-42-23-15-8-16-24-42)54(64-46)38-62-52(3,4)66-54/h5-28,45-50H,29-38H2,1-4H3/t45-,46-,47-,48-,49+,50+,53+,54+/m0/s1
InChIKey DNRIJTIQXYDIIK-HFRMKBDPSA-N
Mol Weight 903.1 g/mol
Molecular Formula C54H62O12
Exact Mass 902.424127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Bzk42Zsnqu
Name 1,4-BIS-[(3,4-DI-O-BENZYL-1,2-O-ISOPROPYLIDENE-BETA-D-FRUCTOFURANOSE-6-O-YL)-METHYL]-BENZENE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H62O12
InChI InChI=1S/C54H62O12/c1-51(2)61-37-53(65-51)49(59-33-41-21-13-7-14-22-41)47(57-31-39-17-9-5-10-18-39)45(63-53)35-55-29-43-25-27-44(28-26-43)30-56-36-46-48(58-32-40-19-11-6-12-20-40)50(60-34-42-23-15-8-16-24-42)54(64-46)38-62-52(3,4)66-54/h5-28,45-50H,29-38H2,1-4H3/t45-,46-,47-,48-,49+,50+,53+,54+/m0/s1
InChIKey DNRIJTIQXYDIIK-HFRMKBDPSA-N
Literature Reference Author E.M.RUBIO,C.O.MELLET,J.M.G.FERNANDEZ
Literature Reference Citation ORG.LETTERS,5,873(2003)
Literature Reference DOI 10.1021/ol034022c
Molecular Weight 903.079 g/mol
Sample ID 47331
Solvent CDCl3