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1',2,3,3',4,4'-HEXA-O-BENZYL-6'-O-(2-TERT.-BUTOXY-2-OXOETHYL)-SUCROSE
SpectraBase Compound ID W9FLDMqfCL
InChI InChI=1S/C60H68O13/c1-59(2,3)72-52(62)42-63-41-51-54(66-37-46-26-14-6-15-27-46)57(69-40-49-32-20-9-21-33-49)60(71-51,43-64-35-44-22-10-4-11-23-44)73-58-56(68-39-48-30-18-8-19-31-48)55(67-38-47-28-16-7-17-29-47)53(50(34-61)70-58)65-36-45-24-12-5-13-25-45/h4-33,50-51,53-58,61H,34-43H2,1-3H3/t50-,51-,53-,54-,55+,56-,57+,58-,60+/m0/s1
InChIKey WYRRWURBQVTQLO-ZNKDUMTQSA-N
Mol Weight 997.2 g/mol
Molecular Formula C60H68O13
Exact Mass 996.465992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATW9QLFwBPN
Name 1',2,3,3',4,4'-HEXA-O-BENZYL-6'-O-(2-TERT.-BUTOXY-2-OXOETHYL)-SUCROSE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H68O13
InChI InChI=1S/C60H68O13/c1-59(2,3)72-52(62)42-63-41-51-54(66-37-46-26-14-6-15-27-46)57(69-40-49-32-20-9-21-33-49)60(71-51,43-64-35-44-22-10-4-11-23-44)73-58-56(68-39-48-30-18-8-19-31-48)55(67-38-47-28-16-7-17-29-47)53(50(34-61)70-58)65-36-45-24-12-5-13-25-45/h4-33,50-51,53-58,61H,34-43H2,1-3H3/t50-,51-,53-,54-,55+,56-,57+,58-,60+/m0/s1
InChIKey WYRRWURBQVTQLO-ZNKDUMTQSA-N
Literature Reference Author M.A.POTOPNYL,S.JAROSZ
Literature Reference Citation EUR.J.ORG.CHEM.,2013,5117(2013)
Literature Reference DOI 10.1002/ejoc.201300427
Molecular Weight 997.192 g/mol
Solvent CDCl3
Source File Reference UWBT18913