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(1S,3S,4R )-4,7-Diacetoxy-8-methoxy-1,3-dimethylisochroman
SpectraBase Compound ID DGTY6aJUNxl
InChI InChI=1S/C16H20O6/c1-8-14-12(15(9(2)20-8)22-11(4)18)6-7-13(16(14)19-5)21-10(3)17/h6-9,15H,1-5H3/t8-,9-,15-/m0/s1
InChIKey GFHCIEBMSFRZSJ-UTEYVOQOSA-N
Mol Weight 308.33 g/mol
Molecular Formula C16H20O6
Exact Mass 308.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BEdfLX1JCfN
Name (1S,3S,4R)-4,7-DIACETOXY-8-METHOXY-1,3-DIMETHYLISOCHROMAN
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O6
InChI InChI=1S/C16H20O6/c1-8-14-12(15(9(2)20-8)22-11(4)18)6-7-13(16(14)19-5)21-10(3)17/h6-9,15H,1-5H3/t8-,9-,15-/m0/s1
InChIKey GFHCIEBMSFRZSJ-UTEYVOQOSA-N
Literature Reference Author R.G.F.GILES,I.R.GREEN,Y.GRUCHLIK,F.J.OOSTHUIZEN
Literature Reference Citation AUSTR.J.CHEM.,53,341(2000)
Literature Reference DOI 10.1071/CH00020
Molecular Weight 308.331 g/mol
Solvent CDCl3
Source File Reference UWSI2939