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METHYL_3'-CHLORO-4'-(ALPHA-D-MANNOPYRANOSYLOXY)-BIPHENYL-4-CARBOXYLATE
SpectraBase Compound ID 3wKpfBY8iuM
InChI InChI=1S/C20H21ClO8/c1-27-19(26)11-4-2-10(3-5-11)12-6-7-14(13(21)8-12)28-20-18(25)17(24)16(23)15(9-22)29-20/h2-8,15-18,20,22-25H,9H2,1H3
InChIKey UYZZOIIIXKXPFB-UHFFFAOYSA-N
Mol Weight 424.83 g/mol
Molecular Formula C20H21ClO8
Exact Mass 424.092495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELXM21ARgl7
Name METHYL_3'-CHLORO-4'-(ALPHA-D-MANNOPYRANOSYLOXY)-BIPHENYL-4-CARBOXYLATE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21ClO8
InChI InChI=1S/C20H21ClO8/c1-27-19(26)11-4-2-10(3-5-11)12-6-7-14(13(21)8-12)28-20-18(25)17(24)16(23)15(9-22)29-20/h2-8,15-18,20,22-25H,9H2,1H3
InChIKey UYZZOIIIXKXPFB-UHFFFAOYSA-N
Literature Reference Author T.KLEIN,D.ABGOTTSPON,M.WITTWER,S.RABBANI,J.HEROLD,X.JIANG,S. KLEEB,C.LUETHI,M.SCH
Literature Reference Citation J.MED.CHEM.,53,8627(2010)
Literature Reference DOI 10.1021/jm101011y
Molecular Weight 424.835 g/mol
Solvent CD3OD
Source File Reference UWMZ47659