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N-[(2,5-DIHYDROXYCYCLOPENTYL)-1-(N6-(PARA-METHOXYBENZOYL)-ADENIN-1-YL)-ACETAMIDE

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N-[(2,5-DIHYDROXYCYCLOPENTYL)-1-(N6-(PARA-METHOXYBENZOYL)-ADENIN-1-YL)-ACETAMIDE
SpectraBase Compound ID JQz0KfMZYQp
InChI InChI=1S/C20H22N6O5/c1-31-12-4-2-11(3-5-12)20(30)25-18-17-19(22-9-21-18)26(10-23-17)8-15(29)24-16-13(27)6-7-14(16)28/h2-5,9-10,13-14,16,27-28H,6-8H2,1H3,(H,24,29)(H,21,22,25,30)/t13-,14-/m0/s1
InChIKey FEYZKROMUDVAMX-KBPBESRZSA-N
Mol Weight 426.43 g/mol
Molecular Formula C20H22N6O5
Exact Mass 426.165168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ByslRRlvt3A
Name N-[(2,5-DIHYDROXYCYCLOPENTYL)-1-(N6-(PARA-METHOXYBENZOYL)-ADENIN-1-YL)-ACETAMIDE
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N6O5
InChI InChI=1S/C20H22N6O5/c1-31-12-4-2-11(3-5-12)20(30)25-18-17-19(22-9-21-18)26(10-23-17)8-15(29)24-16-13(27)6-7-14(16)28/h2-5,9-10,13-14,16,27-28H,6-8H2,1H3,(H,24,29)(H,21,22,25,30)/t13-,14-/m0/s1
InChIKey FEYZKROMUDVAMX-KBPBESRZSA-N
Literature Reference Author D.R.AHN,M.MOSIMANN,C.J.LEUMANN
Literature Reference Citation J.ORG.CHEM.,68,7693(2003)
Literature Reference DOI 10.1021/jo034143q
Molecular Weight 426.432 g/mol
Solvent DMSO-D6
Source File Reference UWLU27393