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(E)-2-AMINO-6-CHLORO-9-(PROP-1-EN-1-YL)-9H-PURINE
SpectraBase Compound ID 3AOQ6CMQBzu
InChI InChI=1S/C8H9ClN5/c1-2-3-14-4-11-5-6(9)12-8(10)13-7(5)14/h2-4,11H,1H3,(H2,10,12,13)/b3-2+
InChIKey KHXVFUSYCCHILX-NSCUHMNNSA-N
Mol Weight 210.65 g/mol
Molecular Formula C8H9ClN5
Exact Mass 210.054648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FjX1NuGFYNs
Name (E)-2-AMINO-6-CHLORO-9-(PROP-1-EN-1-YL)-9H-PURINE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9ClN5
InChI InChI=1S/C8H9ClN5/c1-2-3-14-4-11-5-6(9)12-8(10)13-7(5)14/h2-4,11H,1H3,(H2,10,12,13)/b3-2+
InChIKey KHXVFUSYCCHILX-NSCUHMNNSA-N
Literature Reference Author J.KANIA,L.L.GUNDERSEN
Literature Reference Citation EUR.J.ORG.CHEM.,2013,2008(2013)
Literature Reference DOI 10.1002/ejoc.201201455
Molecular Weight 210.646 g/mol
Solvent DMSO-D6
Source File Reference UWBT17661