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benzoic acid [(2R,3R,4S,5R,6S)-4,5-diacetoxy-3-hydroxy-6-methoxy-tetrahydropyran-2-yl]methyl ester
SpectraBase Compound ID 4ksr2JtRGuz
InChI InChI=1S/C18H22O9/c1-10(19)25-15-14(21)13(27-18(23-3)16(15)26-11(2)20)9-24-17(22)12-7-5-4-6-8-12/h4-8,13-16,18,21H,9H2,1-3H3/t13-,14-,15+,16-,18+/m1/s1
InChIKey CNGAZEBWIIDYHF-QFXBJFAPSA-N
Mol Weight 382.37 g/mol
Molecular Formula C18H22O9
Exact Mass 382.126382 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6fxgl5u9OdZ
Name benzoic acid [(2R,3R,4S,5R,6S)-4,5-diacetoxy-3-hydroxy-6-methoxy-tetrahydropyran-2-yl]methyl ester
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O9
InChI InChI=1S/C18H22O9/c1-10(19)25-15-14(21)13(27-18(23-3)16(15)26-11(2)20)9-24-17(22)12-7-5-4-6-8-12/h4-8,13-16,18,21H,9H2,1-3H3/t13-,14-,15+,16-,18+/m1/s1
InChIKey CNGAZEBWIIDYHF-QFXBJFAPSA-N
Literature Reference Author F.W.D.SOUZA,T.L.LOWARY
Literature Reference Citation J.ORG.CHEM.,63,3166(1998)
Literature Reference DOI 10.1021/jo980276d
Solvent CDCl3
Source File Reference UWLU37094