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9-[(2-HYDROXY-1-(HYDROXYMETHYL)-ETHOXY]-METHYL]-6-CHLOROPURINE
SpectraBase Compound ID BjvXocWfWX5
InChI InChI=1S/C9H11ClN4O3/c10-8-7-9(12-3-11-8)14(4-13-7)5-17-6(1-15)2-16/h3-4,6,15-16H,1-2,5H2
InChIKey WHEMSHQTIDBRAQ-UHFFFAOYSA-N
Mol Weight 258.67 g/mol
Molecular Formula C9H11ClN4O3
Exact Mass 258.051968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K88GW1BYevf
Name 9-[(2-HYDROXY-1-(HYDROXYMETHYL)-ETHOXY]-METHYL]-6-CHLOROPURINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11ClN4O3
InChI InChI=1S/C9H11ClN4O3/c10-8-7-9(12-3-11-8)14(4-13-7)5-17-6(1-15)2-16/h3-4,6,15-16H,1-2,5H2
InChIKey WHEMSHQTIDBRAQ-UHFFFAOYSA-N
Literature Reference Author K.K.OGILVIE,N.NGUYEN-BA,M.F.GILLEN,B.K.RADATUS,U.O.CHERIYAN, H.R.HANNA,K.O.SMITH,
Literature Reference Citation CAN.J.CHEM.,62,241(1984)
Literature Reference DOI 10.1139/v84-039
Molecular Weight 258.664 g/mol
Solvent DMSO-D6
Source File Reference UWED4595