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N-[9-[(3aR,4R,6R,6aR)-2,2-dimethyl-4-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]purin-6-yl]carbamic acid benzyl ester

View entire compound with spectra: 1 NMR

N-[9-[(3aR,4R,6R,6aR)-2,2-dimethyl-4-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]purin-6-yl]carbamic acid benzyl ester
SpectraBase Compound ID JH6C6bUhHYp
InChI InChI=1S/C21H23N5O6/c1-21(2)31-15-13(8-27)30-19(16(15)32-21)26-11-24-14-17(22-10-23-18(14)26)25-20(28)29-9-12-6-4-3-5-7-12/h3-7,10-11,13,15-16,19,27H,8-9H2,1-2H3,(H,22,23,25,28)/t13-,15-,16-,19-/m1/s1
InChIKey PGVNYXXMJLITIB-NVQRDWNXSA-N
Mol Weight 441.44 g/mol
Molecular Formula C21H23N5O6
Exact Mass 441.164833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3aSOAmkOgKj
Name N-[9-[(3aR,4R,6R,6aR)-2,2-dimethyl-4-methylol-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl]purin-6-yl]carbamic acid benzyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N5O6
InChI InChI=1S/C21H23N5O6/c1-21(2)31-15-13(8-27)30-19(16(15)32-21)26-11-24-14-17(22-10-23-18(14)26)25-20(28)29-9-12-6-4-3-5-7-12/h3-7,10-11,13,15-16,19,27H,8-9H2,1-2H3,(H,22,23,25,28)/t13-,15-,16-,19-/m1/s1
InChIKey PGVNYXXMJLITIB-NVQRDWNXSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 441.444 g/mol
Source File Reference MHKO15950