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(E,E)-2,3,4,6-TETRA-O-BENZYL-D-GLUCONO-1,5-LACTONE-AZINE
SpectraBase Compound ID LaJFQxzch09
InChI InChI=1S/C68H68N2O10/c1-9-25-51(26-10-1)41-71-49-59-61(73-43-53-29-13-3-14-30-53)63(75-45-55-33-17-5-18-34-55)65(77-47-57-37-21-7-22-38-57)67(79-59)69-70-68-66(78-48-58-39-23-8-24-40-58)64(76-46-56-35-19-6-20-36-56)62(74-44-54-31-15-4-16-32-54)60(80-68)50-72-42-52-27-11-2-12-28-52/h1-40,59-66H,41-50H2/b69-67+,70-68+/t59-,60-,61-,62-,63+,64+,65-,66-/m0/s1
InChIKey PGBOWFBYSXESED-LXXMCRNRSA-N
Mol Weight 1073.3 g/mol
Molecular Formula C68H68N2O10
Exact Mass 1072.487396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1DyDvcOB43
Name (E,E)-2,3,4,6-TETRA-O-BENZYL-D-GLUCONO-1,5-LACTONE-AZINE
Compound Number 57
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C68H68N2O10
InChI InChI=1S/C68H68N2O10/c1-9-25-51(26-10-1)41-71-49-59-61(73-43-53-29-13-3-14-30-53)63(75-45-55-33-17-5-18-34-55)65(77-47-57-37-21-7-22-38-57)67(79-59)69-70-68-66(78-48-58-39-23-8-24-40-58)64(76-46-56-35-19-6-20-36-56)62(74-44-54-31-15-4-16-32-54)60(80-68)50-72-42-52-27-11-2-12-28-52/h1-40,59-66H,41-50H2/b69-67+,70-68+/t59-,60-,61-,62-,63+,64+,65-,66-/m0/s1
InChIKey PGBOWFBYSXESED-LXXMCRNRSA-N
Literature Reference Author A.VASELLA,C.WITZIG,C.WALDRAFF,P.UHLMANN,K.BRINER,B.BERNET,L. PANZA,R.HUSI
Literature Reference Citation HELV.CHIM.ACTA,76,2847(1993)
Literature Reference DOI 10.1002/hlca.19930760811
Molecular Weight 1073.295 g/mol
Solvent CDCl3
Source File Reference UWCS16311