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METHYL-4-DEOXY-3-C-[(R)-(ETHOXYCARBONYL)-HYDROXYMETHYL]-2,6-DI-O-PIVALOYL-ALPHA-D-XYLOHEXOPYRANOSIDE
SpectraBase Compound ID 7h3dki75GoD
InChI InChI=1S/C21H36O10/c1-9-28-15(23)13(22)21(26)10-12(11-29-17(24)19(2,3)4)30-16(27-8)14(21)31-18(25)20(5,6)7/h12-14,16,22,26H,9-11H2,1-8H3/t12-,13?,14-,16-,21+/m0/s1
InChIKey AQTPLBIWLDTWTM-RRYJUPOVSA-N
Mol Weight 448.5 g/mol
Molecular Formula C21H36O10
Exact Mass 448.230847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H8K36D4j2yV
Name METHYL-4-DEOXY-3-C-[(R)-(ETHOXYCARBONYL)-HYDROXYMETHYL]-2,6-DI-O-PIVALOYL-ALPHA-D-XYLOHEXOPYRANOSIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36O10
InChI InChI=1S/C21H36O10/c1-9-28-15(23)13(22)21(26)10-12(11-29-17(24)19(2,3)4)30-16(27-8)14(21)31-18(25)20(5,6)7/h12-14,16,22,26H,9-11H2,1-8H3/t12-,13?,14-,16-,21+/m0/s1
InChIKey AQTPLBIWLDTWTM-RRYJUPOVSA-N
Literature Reference Author A.P.RAUTER,A.C.FERNANDES,S.CZERNECKI,J.M.VALERY
Literature Reference Citation J.ORG.CHEM.,61,3594(1996)
Literature Reference DOI 10.1021/jo952220e
Molecular Weight 448.511 g/mol
Solvent CDCl3
Source File Reference UWCS21871