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9-[[(1R,2S,3S)-3-[[TERT.-BUTYL-(DIPHENYL)-SILYL]-OXY]-2-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-CYCLOBUTYL]-METHYL]-6-CHLORO-9H-PURIN-2-AMINE

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9-[[(1R,2S,3S)-3-[[TERT.-BUTYL-(DIPHENYL)-SILYL]-OXY]-2-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-CYCLOBUTYL]-METHYL]-6-CHLORO-9H-PURIN-2-AMINE
SpectraBase Compound ID 9H5HWog5Gma
InChI InChI=1S/C31H38ClN5O3Si/c1-30(2,3)41(21-12-8-6-9-13-21,22-14-10-7-11-15-22)40-23-16-20(25(23)24-18-38-31(4,5)39-24)17-37-19-34-26-27(32)35-29(33)36-28(26)37/h6-15,19-20,23-25H,16-18H2,1-5H3,(H2,33,35,36)/t20-,23-,24+,25+/m0/s1
InChIKey IYRXOZYEVPRGPI-MNPDLOSFSA-N
Mol Weight 592.2 g/mol
Molecular Formula C31H38ClN5O3Si
Exact Mass 591.243244 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H72yujJ0wDK
Name 9-[[(1R,2S,3S)-3-[[TERT.-BUTYL-(DIPHENYL)-SILYL]-OXY]-2-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-CYCLOBUTYL]-METHYL]-6-CHLORO-9H-PURIN-2-AMINE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38ClN5O3Si
InChI InChI=1S/C31H38ClN5O3Si/c1-30(2,3)41(21-12-8-6-9-13-21,22-14-10-7-11-15-22)40-23-16-20(25(23)24-18-38-31(4,5)39-24)17-37-19-34-26-27(32)35-29(33)36-28(26)37/h6-15,19-20,23-25H,16-18H2,1-5H3,(H2,33,35,36)/t20-,23-,24+,25+/m0/s1
InChIKey IYRXOZYEVPRGPI-MNPDLOSFSA-N
Literature Reference Author R.MIRALLES-LLUMA,A.FIGUERAS,F.BUSQUE,A.ALVAREZ-LARENA,J.BALZ ARINI,M.FIGUEREDO,
Literature Reference Citation EUR.J.ORG.CHEM.,2013,7761(2013)
Literature Reference DOI 10.1002/ejoc.201301097
Molecular Weight 592.213 g/mol
Solvent CDCl3
Source File Reference UWBT20203