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2-ACETAMIDO-8-HYDROXY-9-PHOSPHORYL-8,9-CIS-DIHYDRODIPYRIDO-[1,2-A;3',2'-D]-IMIDAZOLE
SpectraBase Compound ID BmP6ATwe8jS
InChI InChI=1S/C12H13N4O6P/c1-6(17)13-9-4-2-7-11(15-9)16-10(14-7)5-3-8(18)12(16)22-23(19,20)21/h2-5,8,12,18H,1H3,(H,13,15,17)(H2,19,20,21)/p-2/t8-,12-/m1/s1
InChIKey WBLLTOUKQWEYDU-PRHODGIISA-L
Mol Weight 338.22 g/mol
Molecular Formula C12H11N4O6P
Exact Mass 338.041621 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DlqeMJfBkDN
Name 2-ACETAMIDO-8-HYDROXY-9-PHOSPHORYL-8,9-CIS-DIHYDRODIPYRIDO-[1,2-A;3',2'-D]-IMIDAZOLE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N4O6P
InChI InChI=1S/C12H13N4O6P/c1-6(17)13-9-4-2-7-11(15-9)16-10(14-7)5-3-8(18)12(16)22-23(19,20)21/h2-5,8,12,18H,1H3,(H,13,15,17)(H2,19,20,21)/p-2/t8-,12-/m1/s1
InChIKey WBLLTOUKQWEYDU-PRHODGIISA-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 338.216 g/mol
Sample ID 35102
Solvent DMSO-D6