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7-(2',3',4'-TRI-O-ACETYL-ALPHA-L-ARABINOPYRANOSYL)-THEOPHYLLINE
SpectraBase Compound ID IodVMNZLd0I
InChI InChI=1S/C18H22N4O9/c1-8(23)29-11-6-28-17(14(31-10(3)25)13(11)30-9(2)24)22-7-19-15-12(22)16(26)21(5)18(27)20(15)4/h7,11,13-14,17H,6H2,1-5H3/t11-,13-,14+,17+/m0/s1
InChIKey XAPZOHBOMPPJLG-HVOFVXBASA-N
Mol Weight 438.39 g/mol
Molecular Formula C18H22N4O9
Exact Mass 438.138678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25gEvSmAWPQ
Name 7-(2',3',4'-TRI-O-ACETYL-ALPHA-L-ARABINOPYRANOSYL)-THEOPHYLLINE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N4O9
InChI InChI=1S/C18H22N4O9/c1-8(23)29-11-6-28-17(14(31-10(3)25)13(11)30-9(2)24)22-7-19-15-12(22)16(26)21(5)18(27)20(15)4/h7,11,13-14,17H,6H2,1-5H3/t11-,13-,14+,17+/m0/s1
InChIKey XAPZOHBOMPPJLG-HVOFVXBASA-N
Literature Reference Author R.R.GOMEZ,J.R.RUIZ
Literature Reference Citation HETEROCYCLES,43,317(1996)
Literature Reference DOI 10.3987/COM-95-7259
Molecular Weight 438.394 g/mol
Solvent CDCl3
Source File Reference UWCS19379