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1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-(1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-)-BUT-2-ENYL-D-SORBITOL

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1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-(1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-)-BUT-2-ENYL-D-SORBITOL
SpectraBase Compound ID Dk4bxizmR6d
InChI InChI=1S/C58H64O10/c1-7-21-45(22-8-1)35-61-51(55-57(65-39-49-29-15-5-16-30-49)53(43-67-55)63-37-47-25-11-3-12-26-47)41-59-33-19-20-34-60-42-52(62-36-46-23-9-2-10-24-46)56-58(66-40-50-31-17-6-18-32-50)54(44-68-56)64-38-48-27-13-4-14-28-48/h1-32,51-58H,33-44H2/b20-19+/t51-,52-,53-,54+,55+,56-,57+,58-/m1/s1
InChIKey OVCRKGWDDABJQU-FCMUTQGLSA-N
Mol Weight 921.1 g/mol
Molecular Formula C58H64O10
Exact Mass 920.449948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ECqOaFPlfAv
Name 1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-(1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-)-BUT-2-ENYL-D-SORBITOL
Compound Number 2 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H64O10
InChI InChI=1S/C58H64O10/c1-7-21-45(22-8-1)35-61-51(55-57(65-39-49-29-15-5-16-30-49)53(43-67-55)63-37-47-25-11-3-12-26-47)41-59-33-19-20-34-60-42-52(62-36-46-23-9-2-10-24-46)56-58(66-40-50-31-17-6-18-32-50)54(44-68-56)64-38-48-27-13-4-14-28-48/h1-32,51-58H,33-44H2/b20-19+/t51-,52-,53-,54+,55+,56-,57+,58-/m1/s1
InChIKey OVCRKGWDDABJQU-FCMUTQGLSA-N
Literature Reference Author M.TOBER,J.THIEM
Literature Reference Citation EUR.J.ORG.CHEM.,2013,566(2013)
Literature Reference DOI 10.1002/ejoc.201201083
Molecular Weight 921.140 g/mol
Solvent CDCl3
Source File Reference UWBT17522