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2,6-DIMETHYL-9-[3,5-BIS-O-(4-TOLUOYL)-2-DEOXY-BETA-D-ERYTROPENTOFURANOSYL]-PURINE
SpectraBase Compound ID GhEqVGkjIpf
InChI InChI=1S/C28H28N4O5/c1-16-5-9-20(10-6-16)27(33)35-14-23-22(37-28(34)21-11-7-17(2)8-12-21)13-24(36-23)32-15-29-25-18(3)30-19(4)31-26(25)32/h5-12,15,22-24H,13-14H2,1-4H3/t22-,23+,24+/m1/s1
InChIKey CFCWAJXUZIISIK-SGNDLWITSA-N
Mol Weight 500.56 g/mol
Molecular Formula C28H28N4O5
Exact Mass 500.20597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VMmqOU64h1
Name 2,6-DIMETHYL-9-[3,5-BIS-O-(4-TOLUOYL)-2-DEOXY-BETA-D-ERYTROPENTOFURANOSYL]-PURINE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28N4O5
InChI InChI=1S/C28H28N4O5/c1-16-5-9-20(10-6-16)27(33)35-14-23-22(37-28(34)21-11-7-17(2)8-12-21)13-24(36-23)32-15-29-25-18(3)30-19(4)31-26(25)32/h5-12,15,22-24H,13-14H2,1-4H3/t22-,23+,24+/m1/s1
InChIKey CFCWAJXUZIISIK-SGNDLWITSA-N
Literature Reference Author M.HOCEK,H.DVORAKOVA
Literature Reference Citation J.ORG.CHEM.,68,5773(2003)
Literature Reference DOI 10.1021/jo034351i
Molecular Weight 500.554 g/mol
Solvent CDCl3
Source File Reference UWLU24306