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(1'R,4'S,5'S)-2-AMINO-6-CHLORO-9-[4'-(1'',2''-DIACETOXYETHYL)-CYCLOPENT-2'-EN-1'-YL]-PURINE
SpectraBase Compound ID 6mJ7l7drfvk
InChI InChI=1S/C16H18ClN5O4/c1-8(23)25-6-12(26-9(2)24)10-3-4-11(5-10)22-7-19-13-14(17)20-16(18)21-15(13)22/h3-4,7,10-12H,5-6H2,1-2H3,(H2,18,20,21)/t10-,11+,12-/m1/s1
InChIKey WRRLPBYXXKHLEG-GRYCIOLGSA-N
Mol Weight 379.8 g/mol
Molecular Formula C16H18ClN5O4
Exact Mass 379.104732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HAMS5IXApOb
Name (1'R,4'S,5'S)-2-AMINO-6-CHLORO-9-[4'-(1'',2''-DIACETOXYETHYL)-CYCLOPENT-2'-EN-1'-YL]-PURINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18ClN5O4
InChI InChI=1S/C16H18ClN5O4/c1-8(23)25-6-12(26-9(2)24)10-3-4-11(5-10)22-7-19-13-14(17)20-16(18)21-15(13)22/h3-4,7,10-12H,5-6H2,1-2H3,(H2,18,20,21)/t10-,11+,12-/m1/s1
InChIKey WRRLPBYXXKHLEG-GRYCIOLGSA-N
Literature Reference Author A.DHANDA,L.J.S.KNUTSEN,M.B.NIELSEN,S.M.ROBERTS,D.R.VARLEY
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3469(1999)
Literature Reference DOI 10.1039/a906464h
Molecular Weight 379.803 g/mol
Solvent CDCl3
Source File Reference UWKP2708