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5-AMINO-3-(2,3-DIDEOXY-BETA-D-GLYCERO-PENTOFURANOSYL)-3,6-DIHYDRO-7H-1,2,3-TRIAZOLO-[4,5-D]-PYRIMIDIN-7-ONE
SpectraBase Compound ID 1kBjOsI03fN
InChI InChI=1S/C9H12N6O3/c10-9-11-7-6(8(17)12-9)13-14-15(7)5-2-1-4(3-16)18-5/h4-5,16H,1-3H2,(H3,10,11,12,17)/t4-,5+/m0/s1
InChIKey CVDDQUXFTAOOPE-CRCLSJGQSA-N
Mol Weight 252.23 g/mol
Molecular Formula C9H12N6O3
Exact Mass 252.097088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I7DUiuUTkCQ
Name 5-AMINO-3-(2,3-DIDEOXY-BETA-D-GLYCERO-PENTOFURANOSYL)-3,6-DIHYDRO-7H-1,2,3-TRIAZOLO-[4,5-D]-PYRIMIDIN-7-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12N6O3
InChI InChI=1S/C9H12N6O3/c10-9-11-7-6(8(17)12-9)13-14-15(7)5-2-1-4(3-16)18-5/h4-5,16H,1-3H2,(H3,10,11,12,17)/t4-,5+/m0/s1
InChIKey CVDDQUXFTAOOPE-CRCLSJGQSA-N
Literature Reference Author F.SEELA,K.MERSMANN
Literature Reference Citation HELV.CHIM.ACTA,76,2184(1993)
Literature Reference DOI 10.1002/hlca.19930760603
Molecular Weight 252.233 g/mol
Solvent DMSO-D6
Source File Reference UWVP4678