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1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-TRITYL-D-SORBITOL
SpectraBase Compound ID 7aN0jpC7q1d
InChI InChI=1S/C46H44O5/c1-7-19-36(20-8-1)31-47-42-34-50-45(44(42)49-33-38-23-11-3-12-24-38)43(48-32-37-21-9-2-10-22-37)35-51-46(39-25-13-4-14-26-39,40-27-15-5-16-28-40)41-29-17-6-18-30-41/h1-30,42-45H,31-35H2/t42-,43+,44+,45+/m0/s1
InChIKey HQYCSOMMCXUDDX-HLBUBFAMSA-N
Mol Weight 676.9 g/mol
Molecular Formula C46H44O5
Exact Mass 676.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2MOlOHCIpWF
Name 1,4-ANHYDRO-2,3,5-TRI-O-BENZYL-6-O-TRITYL-D-SORBITOL
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H44O5
InChI InChI=1S/C46H44O5/c1-7-19-36(20-8-1)31-47-42-34-50-45(44(42)49-33-38-23-11-3-12-24-38)43(48-32-37-21-9-2-10-22-37)35-51-46(39-25-13-4-14-26-39,40-27-15-5-16-28-40)41-29-17-6-18-30-41/h1-30,42-45H,31-35H2/t42-,43+,44+,45+/m0/s1
InChIKey HQYCSOMMCXUDDX-HLBUBFAMSA-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 676.852 g/mol
Solvent DMSO-D6
Source File Reference UWBT17510