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1-[(7-HYDROXY-2-OXO-2H-CHROMEN-4-YL)-METHYL]-6-CHLORO-PURINE
SpectraBase Compound ID JXLJk30dLrI
InChI InChI=1S/C15H9ClN4O3/c16-14-13-15(18-6-17-14)20(7-19-13)5-8-3-12(22)23-11-4-9(21)1-2-10(8)11/h1-4,6-7,21H,5H2
InChIKey XFCJCHAYDQMQTE-UHFFFAOYSA-N
Mol Weight 328.72 g/mol
Molecular Formula C15H9ClN4O3
Exact Mass 328.036318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EL2yN2D6XDT
Name 1-[(7-HYDROXY-2-OXO-2H-CHROMEN-4-YL)-METHYL]-6-CHLORO-PURINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H9ClN4O3
InChI InChI=1S/C15H9ClN4O3/c16-14-13-15(18-6-17-14)20(7-19-13)5-8-3-12(22)23-11-4-9(21)1-2-10(8)11/h1-4,6-7,21H,5H2
InChIKey XFCJCHAYDQMQTE-UHFFFAOYSA-N
Literature Reference Author K.BENCI,L.MANDIC,T.SUHINA,M.SEDIC,M.KLOBUCAR,S.K.PAVELIC,K.P AVELIC,K.WITTINE
Literature Reference Citation MOLECULES,17,11010(2012)
Literature Reference DOI 10.3390/molecules170911010
Molecular Weight 328.714 g/mol
Sample ID 688
Solvent DMSO-D6