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(1S,2S,3S,4S,5R,6R)-3,4,5-TRIS-(BENZYLOXY)-6-((BENZYLOXY)-METHYL)-BICYCLO-[4.1.0]-HEPTAN-2-OL
SpectraBase Compound ID 78GlP16PhsA
InChI InChI=1S/C36H38O5/c37-32-31-21-36(31,26-38-22-27-13-5-1-6-14-27)35(41-25-30-19-11-4-12-20-30)34(40-24-29-17-9-3-10-18-29)33(32)39-23-28-15-7-2-8-16-28/h1-20,31-35,37H,21-26H2/t31-,32+,33+,34-,35+,36+/m1/s1
InChIKey WQQDNRSREREXPX-YTIMIXIJSA-N
Mol Weight 550.7 g/mol
Molecular Formula C36H38O5
Exact Mass 550.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FKTSFFCgJzV
Name (1S,2S,3S,4S,5R,6R)-3,4,5-TRIS-(BENZYLOXY)-6-((BENZYLOXY)-METHYL)-BICYCLO-[4.1.0]-HEPTAN-2-OL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O5
InChI InChI=1S/C36H38O5/c37-32-31-21-36(31,26-38-22-27-13-5-1-6-14-27)35(41-25-30-19-11-4-12-20-30)34(40-24-29-17-9-3-10-18-29)33(32)39-23-28-15-7-2-8-16-28/h1-20,31-35,37H,21-26H2/t31-,32+,33+,34-,35+,36+/m1/s1
InChIKey WQQDNRSREREXPX-YTIMIXIJSA-N
Literature Reference Author V.DOOKHUN,A.J.BENNET
Literature Reference Citation CAN.J.CHEM.,82,1361(2004)
Literature Reference DOI 10.1139/v04-109
Molecular Weight 550.695 g/mol
Solvent CDCl3
Source File Reference UWMS28737