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1-(METHYL-2-O-BENZYL-4,6-O-BENZYLIDENE-3-DEOXY-ALPHA-D-ALTROPYRANOSID-3-YL)-BUT-3-YN-2-ONE
SpectraBase Compound ID 4TXL2EFwUfw
InChI InChI=1S/C25H26O6/c1-3-19(26)14-20-22-21(16-29-24(31-22)18-12-8-5-9-13-18)30-25(27-2)23(20)28-15-17-10-6-4-7-11-17/h1,4-13,20-25H,14-16H2,2H3/t20-,21-,22+,23+,24-,25+/m1/s1
InChIKey YTVOLUXLPQRPPQ-LUXCBIKGSA-N
Mol Weight 422.48 g/mol
Molecular Formula C25H26O6
Exact Mass 422.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8pU6VcJQMoJ
Name 1-(METHYL-2-O-BENZYL-4,6-O-BENZYLIDENE-3-DEOXY-ALPHA-D-ALTROPYRANOSID-3-YL)-BUT-3-YN-2-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26O6
InChI InChI=1S/C25H26O6/c1-3-19(26)14-20-22-21(16-29-24(31-22)18-12-8-5-9-13-18)30-25(27-2)23(20)28-15-17-10-6-4-7-11-17/h1,4-13,20-25H,14-16H2,2H3/t20-,21-,22+,23+,24-,25+/m1/s1
InChIKey YTVOLUXLPQRPPQ-LUXCBIKGSA-N
Literature Reference Author I.OTERO,H.FEIST,L.HERRERA,M.MICHALIK,J.QUINCOCES,K.PESEKE
Literature Reference Citation AUSTR.J.CHEM.,58,104(2005)
Literature Reference DOI 10.1071/CH04168
Molecular Weight 422.478 g/mol
Sample ID 28906
Solvent CDCl3