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6-[(6-AMINO-9H-PURIN-9-YL)-METHYL]-6-METHYL-3,6-DIHYDRO-2H-PYRAN-4-YLPHOSPHONATE
SpectraBase Compound ID KvCmQgmKDV7
InChI InChI=1S/C12H16N5O4P/c1-12(4-8(2-3-21-12)22(18,19)20)5-17-7-16-9-10(13)14-6-15-11(9)17/h4,6-7H,2-3,5H2,1H3,(H2,13,14,15)(H2,18,19,20)
InChIKey WMFHVAQYJIJASJ-UHFFFAOYSA-N
Mol Weight 325.26 g/mol
Molecular Formula C12H16N5O4P
Exact Mass 325.093991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BrAYu7ll3Xo
Name 6-[(6-AMINO-9H-PURIN-9-YL)-METHYL]-6-METHYL-3,6-DIHYDRO-2H-PYRAN-4-YLPHOSPHONATE
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N5O4P
InChI InChI=1S/C12H16N5O4P/c1-12(4-8(2-3-21-12)22(18,19)20)5-17-7-16-9-10(13)14-6-15-11(9)17/h4,6-7H,2-3,5H2,1H3,(H2,13,14,15)(H2,18,19,20)
InChIKey WMFHVAQYJIJASJ-UHFFFAOYSA-N
Literature Reference Author V.K.BREL,V.K.BELSKY,A.I.STASH,V.E.ZAVODNIK,P.J.STANG
Literature Reference Citation EUR.J.ORG.CHEM.,512(2005)
Molecular Weight 323.248 g/mol
Sample ID 42536
Solvent CD3OD