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2-ACETAMIDO-8-HYDROXY-6-METHYL-9-PHOSPHORYL-8,9-CIS-DIHYDRODIPYRIDO-[1,2-A;3',2'-D]-IMIDAZOLE
SpectraBase Compound ID JISgjMhUw8y
InChI InChI=1S/C13H15N4O6P/c1-6-5-9(19)13(23-24(20,21)22)17-11(6)15-8-3-4-10(14-7(2)18)16-12(8)17/h3-5,9,13,19H,1-2H3,(H,14,16,18)(H2,20,21,22)/p-2/t9-,13-/m1/s1
InChIKey OTFPXIDVORMHJF-NOZJJQNGSA-L
Mol Weight 352.24 g/mol
Molecular Formula C13H13N4O6P
Exact Mass 352.057271 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86AnjzHGYMc
Name 2-ACETAMIDO-8-HYDROXY-6-METHYL-9-PHOSPHORYL-8,9-CIS-DIHYDRODIPYRIDO-[1,2-A;3',2'-D]-IMIDAZOLE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N4O6P
InChI InChI=1S/C13H15N4O6P/c1-6-5-9(19)13(23-24(20,21)22)17-11(6)15-8-3-4-10(14-7(2)18)16-12(8)17/h3-5,9,13,19H,1-2H3,(H,14,16,18)(H2,20,21,22)/p-2/t9-,13-/m1/s1
InChIKey OTFPXIDVORMHJF-NOZJJQNGSA-L
Literature Reference Author M.NOVAK,K.TOTH,S.RAJAGOPAL,M.BROOKS,L.L.HOTT,M.MOSLENER
Literature Reference Citation J.AM.CHEM.SOC.,124,7972(2002)
Literature Reference DOI 10.1021/ja0121944
Molecular Weight 352.243 g/mol
Sample ID 35101
Solvent DMSO-D6