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(9-BENZYLPURIN-6-YL)-(BENZO-[1,3]-DIOXOLE-5-YL)-METHANOL

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(9-BENZYLPURIN-6-YL)-(BENZO-[1,3]-DIOXOLE-5-YL)-METHANOL
SpectraBase Compound ID 2hEQqDUTIHH
InChI InChI=1S/C20H16N4O3/c25-19(14-6-7-15-16(8-14)27-12-26-15)17-18-20(22-10-21-17)24(11-23-18)9-13-4-2-1-3-5-13/h1-8,10-11,19,25H,9,12H2
InChIKey FNJSPLBQKYEVIC-UHFFFAOYSA-N
Mol Weight 360.37 g/mol
Molecular Formula C20H16N4O3
Exact Mass 360.12224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7HrLrQLjSU
Name (9-BENZYLPURIN-6-YL)-(BENZO-[1,3]-DIOXOLE-5-YL)-METHANOL
Compound Number 3G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16N4O3
InChI InChI=1S/C20H16N4O3/c25-19(14-6-7-15-16(8-14)27-12-26-15)17-18-20(22-10-21-17)24(11-23-18)9-13-4-2-1-3-5-13/h1-8,10-11,19,25H,9,12H2
InChIKey FNJSPLBQKYEVIC-UHFFFAOYSA-N
Literature Reference Author T.TOBRMAN,D.DVORAK
Literature Reference Citation ORG.LETTERS,5,4289(2003)
Literature Reference DOI 10.1021/ol0355027
Molecular Weight 360.372 g/mol
Sample ID 38879
Solvent CDCl3