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3,7-ANHYDRO-4,5,6,8-TETRA-O-BENZYL-1,1,2,2-TETRAHYDRO-1,2-DIDEOXY-D-GLYCERO-L-MANNOOCTITOL
SpectraBase Compound ID IWYmlRTr22k
InChI InChI=1S/C36H36O5/c1-2-32-34(38-24-29-17-9-4-10-18-29)36(40-26-31-21-13-6-14-22-31)35(39-25-30-19-11-5-12-20-30)33(41-32)27-37-23-28-15-7-3-8-16-28/h1,3-22,32-36H,23-27H2/t32-,33+,34-,35-,36+/m1/s1
InChIKey ODYZSGODFGXEDP-KXLMQISBSA-N
Mol Weight 548.7 g/mol
Molecular Formula C36H36O5
Exact Mass 548.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IjP2q0SPQfS
Name 3,7-ANHYDRO-4,5,6,8-TETRA-O-BENZYL-1,1,2,2-TETRAHYDRO-1,2-DIDEOXY-D-GLYCERO-L-MANNOOCTITOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H36O5
InChI InChI=1S/C36H36O5/c1-2-32-34(38-24-29-17-9-4-10-18-29)36(40-26-31-21-13-6-14-22-31)35(39-25-30-19-11-5-12-20-30)33(41-32)27-37-23-28-15-7-3-8-16-28/h1,3-22,32-36H,23-27H2/t32-,33+,34-,35-,36+/m1/s1
InChIKey ODYZSGODFGXEDP-KXLMQISBSA-N
Literature Reference Author T.LOWARY,M.MELDAL,A.HELMBOLDT,A.VASELLA,K.BOCK
Literature Reference Citation J.ORG.CHEM.,63,9657(1998)
Literature Reference DOI 10.1021/jo980517h
Molecular Weight 548.679 g/mol
Sample ID 26613
Solvent CDCl3