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2-AMINO-9-(2-HYDROXY-2-PHENYLETHYL)-6-CHLOROPURINE
SpectraBase Compound ID 2kizt9LZDcB
InChI InChI=1S/C13H12ClN5O/c14-11-10-12(18-13(15)17-11)19(7-16-10)6-9(20)8-4-2-1-3-5-8/h1-5,7,9,20H,6H2,(H2,15,17,18)
InChIKey FXPOCTYFADHVJD-UHFFFAOYSA-N
Mol Weight 289.73 g/mol
Molecular Formula C13H12ClN5O
Exact Mass 289.073038 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55760ULZyo
Name 2-AMINO-9-(2-HYDROXY-2-PHENYLETHYL)-6-CHLOROPURINE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12ClN5O
InChI InChI=1S/C13H12ClN5O/c14-11-10-12(18-13(15)17-11)19(7-16-10)6-9(20)8-4-2-1-3-5-8/h1-5,7,9,20H,6H2,(H2,15,17,18)
InChIKey FXPOCTYFADHVJD-UHFFFAOYSA-N
Literature Reference Author J.NOVAK,I.LINHART,H.DVORAKOVA,V.KUBELKA
Literature Reference Citation ORG.LETTERS,5,637(2003)
Literature Reference DOI 10.1021/ol0272803
Molecular Weight 289.724 g/mol
Sample ID 49453
Solvent DMSO-D6