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1-(2,3,4,6-TETRA-O-BENZYL-BETA-D-GALACTOPYRANOSYL)-4-METHOXY-PENTAN-2-ONE
SpectraBase Compound ID JzGYE4QBzYY
InChI InChI=1S/2C40H46O7/c2*1-30(42-2)23-35(41)24-36-38(44-26-32-17-9-4-10-18-32)40(46-28-34-21-13-6-14-22-34)39(45-27-33-19-11-5-12-20-33)37(47-36)29-43-25-31-15-7-3-8-16-31/h2*3-22,30,36-40H,23-29H2,1-2H3/t2*30-,36+,37-,38+,39+,40-/m11/s1
InChIKey QRQYJPQQXDUSDG-XSVWSZMRSA-N
Mol Weight 1277.6 g/mol
Molecular Formula C80H92O14
Exact Mass 1276.648708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FNkHS1q2vjd
Name 1-(2,3,4,6-TETRA-O-BENZYL-BETA-D-GALACTOPYRANOSYL)-4-METHOXY-PENTAN-2-ONE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C80H92O14
InChI InChI=1S/2C40H46O7/c2*1-30(42-2)23-35(41)24-36-38(44-26-32-17-9-4-10-18-32)40(46-28-34-21-13-6-14-22-34)39(45-27-33-19-11-5-12-20-33)37(47-36)29-43-25-31-15-7-3-8-16-31/h2*3-22,30,36-40H,23-29H2,1-2H3/t2*30-,36+,37-,38+,39+,40-/m11/s1
InChIKey QRQYJPQQXDUSDG-XSVWSZMRSA-N
Literature Reference Author Z.WANG,H.SHAO,E.LACROIX,S.H.WU,H.J.JENNINGS,W.ZOU
Literature Reference Citation J.ORG.CHEM.,68,8097(2003)
Literature Reference DOI 10.1021/jo034446k
Molecular Weight 1277.602 g/mol
Solvent CDCl3
Source File Reference UWVN20975