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2-Methyl-9-.beta.-D-ribofuranosylhypoxanthine
SpectraBase Compound ID 81cBPogn4ng
InChI InChI=1S/C11H14N4O5/c1-4-13-9-6(10(19)14-4)12-3-15(9)11-8(18)7(17)5(2-16)20-11/h3,5,7-8,11,16-18H,2H2,1H3,(H,13,14,19)
InChIKey SOTIPZUHKSPAMN-UHFFFAOYSA-N
Mol Weight 282.26 g/mol
Molecular Formula C11H14N4O5
Exact Mass 282.09642 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ZyhwlkNFmR
Name 2-Methyl-9-.beta.-D-ribofuranosylhypoxanthine
Comments Computed using HOSE algorithm
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Exact Mass 282.096419562 u
Formula C11H14N4O5
InChI InChI=1S/C11H14N4O5/c1-4-13-9-6(10(19)14-4)12-3-15(9)11-8(18)7(17)5(2-16)20-11/h3,5,7-8,11,16-18H,2H2,1H3,(H,13,14,19)
InChIKey SOTIPZUHKSPAMN-UHFFFAOYSA-N
Molecular Weight 282.256 g/mol
SMILES C1(NC(=NC2=C1N=CN2C1C(C(C(CO)O1)O)O)C)=O