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2-AMINO-5-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-7H-6-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID FcV3DElSDzk
InChI InChI=1S/C12H16N4O4/c1-5-2-6-10(14-12(13)15-11(6)19)16(5)9-3-7(18)8(4-17)20-9/h2,7-9,17-18H,3-4H2,1H3,(H3,13,14,15,19)/t7-,8+,9+/m0/s1
InChIKey HCIRFHJRADIFQX-DJLDLDEBSA-N
Mol Weight 280.28 g/mol
Molecular Formula C12H16N4O4
Exact Mass 280.117155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4aJEilfDlte
Name 2-AMINO-5-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-7H-6-METHYL-PYRROLO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4O4
InChI InChI=1S/C12H16N4O4/c1-5-2-6-10(14-12(13)15-11(6)19)16(5)9-3-7(18)8(4-17)20-9/h2,7-9,17-18H,3-4H2,1H3,(H3,13,14,15,19)/t7-,8+,9+/m0/s1
InChIKey HCIRFHJRADIFQX-DJLDLDEBSA-N
Literature Reference Author F.SEELA,H.DEBELAK
Literature Reference Citation J.ORG.CHEM.,66,3303(2001)
Literature Reference DOI 10.1021/jo001498q
Molecular Weight 280.283 g/mol
Solvent DMSO-D6
Source File Reference UWMS26791