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2-AMINO-5-[(3,5-DI-O-ACETYL-2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-AMINO]-4H-IMIDAZOL-4-ONE
SpectraBase Compound ID 5rQGfJ62svK
InChI InChI=1S/C12H16N4O6/c1-5(17)20-4-8-7(21-6(2)18)3-9(22-8)14-10-11(19)16-12(13)15-10/h7-9H,3-4H2,1-2H3,(H3,13,14,15,16,19)/t7-,8-,9-/m0/s1
InChIKey PKLVFPOLXMTURQ-CIUDSAMLSA-N
Mol Weight 312.28 g/mol
Molecular Formula C12H16N4O6
Exact Mass 312.106984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ar5Co2m3ivk
Name 2-AMINO-5-[(3,5-DI-O-ACETYL-2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-AMINO]-4H-IMIDAZOL-4-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4O6
InChI InChI=1S/C12H16N4O6/c1-5(17)20-4-8-7(21-6(2)18)3-9(22-8)14-10-11(19)16-12(13)15-10/h7-9H,3-4H2,1-2H3,(H3,13,14,15,16,19)/t7-,8-,9-/m0/s1
InChIKey PKLVFPOLXMTURQ-CIUDSAMLSA-N
Literature Reference Author J.CADET,M.BERGER,G.W.BUCHKO,P.C.JOSHI,S.RAOUL,J.L.RAVANAT
Literature Reference Citation J.AM.CHEM.SOC.,116,7403(1994)
Literature Reference DOI 10.1021/ja00095a052
Molecular Weight 312.282 g/mol
Solvent DMSO-D6
Source File Reference UWSI714