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BUTYL-(+/-)-T-4-(6-AMINO-9H-PURIN-9-YL)-T-2-[(TERT.-BUTOXY)-METHYL]-CYCLOPENTANE-R-1-ACETATE
SpectraBase Compound ID 79G8BNS80Pl
InChI InChI=1S/C21H33N5O3/c1-5-6-7-28-17(27)10-14-8-16(9-15(14)11-29-21(2,3)4)26-13-25-18-19(22)23-12-24-20(18)26/h12-16H,5-11H2,1-4H3,(H2,22,23,24)/t14-,15-,16+/m1/s1
InChIKey XJOWXHQJSDETJU-OAGGEKHMSA-N
Mol Weight 403.5 g/mol
Molecular Formula C21H33N5O3
Exact Mass 403.25834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CqB7k2mxSsZ
Name BUTYL-(+/-)-T-4-(6-AMINO-9H-PURIN-9-YL)-T-2-[(TERT.-BUTOXY)-METHYL]-CYCLOPENTANE-R-1-ACETATE
Compound Number RAC -1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H33N5O3
InChI InChI=1S/C21H33N5O3/c1-5-6-7-28-17(27)10-14-8-16(9-15(14)11-29-21(2,3)4)26-13-25-18-19(22)23-12-24-20(18)26/h12-16H,5-11H2,1-4H3,(H2,22,23,24)/t14-,15-,16+/m1/s1
InChIKey XJOWXHQJSDETJU-OAGGEKHMSA-N
Literature Reference Author J.WANG,A.GOSSAUER
Literature Reference Citation HELV.CHIM.ACTA,77,533(1994)
Literature Reference DOI 10.1002/hlca.19940770214
Molecular Weight 403.525 g/mol
Solvent CDCl3
Source File Reference UWVP4270