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(4R,5R,1'R,1''R)-4,5-DI-(2'-BENZYLOXY-1'-HYDROXYETHYL)-1,3,6-TRIOXEPAN
SpectraBase Compound ID G5oPTJr5Ro7
InChI InChI=1S/C22H28O7/c23-19(13-25-11-17-7-3-1-4-8-17)21-22(29-16-27-15-28-21)20(24)14-26-12-18-9-5-2-6-10-18/h1-10,19-24H,11-16H2/t19-,20-,21+,22+/m0/s1
InChIKey STVRMMHWCWEVSX-FNAHDJPLSA-N
Mol Weight 404.46 g/mol
Molecular Formula C22H28O7
Exact Mass 404.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40MlrCZ3PKU
Name (4R,5R,1'R,1''R)-4,5-DI-(2'-BENZYLOXY-1'-HYDROXYETHYL)-1,3,6-TRIOXEPAN
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O7
InChI InChI=1S/C22H28O7/c23-19(13-25-11-17-7-3-1-4-8-17)21-22(29-16-27-15-28-21)20(24)14-26-12-18-9-5-2-6-10-18/h1-10,19-24H,11-16H2/t19-,20-,21+,22+/m0/s1
InChIKey STVRMMHWCWEVSX-FNAHDJPLSA-N
Literature Reference Author Y.L.MERRER,L.GAUZY,C.GRAVIER-PELLETIER,J.C.DEPEZAY
Literature Reference Citation BIOORG.MED.CHEM.,8,307(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00294-1
Molecular Weight 404.460 g/mol
Solvent CDCl3
Source File Reference UWVN20102