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N-(2-BENZYLAMINO-2-OXOETHYL)-N-BENZYL-6'-AMINO-6'-DEOXY-1',2,3,3',4,4'-HEXA-O-BENZYL-6-O-(2-TERT.-BUTOXY-2-OXOETHYL)-SUCROSE
SpectraBase Compound ID 7iRSDHV7tC6
InChI InChI=1S/C76H84N2O13/c1-75(2,3)90-68(80)55-81-54-66-69(83-49-60-34-18-7-19-35-60)71(85-51-62-38-22-9-23-39-62)72(86-52-63-40-24-10-25-41-63)74(88-66)91-76(56-82-48-59-32-16-6-17-33-59)73(87-53-64-42-26-11-27-43-64)70(84-50-61-36-20-8-21-37-61)65(89-76)46-78(45-58-30-14-5-15-31-58)47-67(79)77-44-57-28-12-4-13-29-57/h4-43,65-66,69-74H,44-56H2,1-3H3,(H,77,79)/t65-,66-,69-,70-,71+,72-,73+,74-,76+/m0/s1
InChIKey PDUABGMJABZQBQ-LXKPTJJOSA-N
Mol Weight 1233.5 g/mol
Molecular Formula C76H84N2O13
Exact Mass 1232.597341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhvnRKjvOQf
Name N-(2-BENZYLAMINO-2-OXOETHYL)-N-BENZYL-6'-AMINO-6'-DEOXY-1',2,3,3',4,4'-HEXA-O-BENZYL-6-O-(2-TERT.-BUTOXY-2-OXOETHYL)-SUCROSE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C76H84N2O13
InChI InChI=1S/C76H84N2O13/c1-75(2,3)90-68(80)55-81-54-66-69(83-49-60-34-18-7-19-35-60)71(85-51-62-38-22-9-23-39-62)72(86-52-63-40-24-10-25-41-63)74(88-66)91-76(56-82-48-59-32-16-6-17-33-59)73(87-53-64-42-26-11-27-43-64)70(84-50-61-36-20-8-21-37-61)65(89-76)46-78(45-58-30-14-5-15-31-58)47-67(79)77-44-57-28-12-4-13-29-57/h4-43,65-66,69-74H,44-56H2,1-3H3,(H,77,79)/t65-,66-,69-,70-,71+,72-,73+,74-,76+/m0/s1
InChIKey PDUABGMJABZQBQ-LXKPTJJOSA-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 1233.509 g/mol
Solvent CDCl3
Source File Reference UWBT18914