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7-CHLORO-1-BETA-D-RIBOFURANOSYLIMIDAZO-[4,5-C]-PYRIDIN-4(5H)-ONE;3-CHLORO-3-DEAZAINOSINE
SpectraBase Compound ID DjRQWMo6aOq
InChI InChI=1S/C11H12ClN3O5/c12-4-1-13-10(19)6-7(4)15(3-14-6)11-9(18)8(17)5(2-16)20-11/h1,3,5,8-9,11,16-18H,2H2,(H,13,19)/t5-,8-,9-,11-/m0/s1
InChIKey QTBAJQDKJNPFFG-SDFZTHMVSA-N
Mol Weight 301.69 g/mol
Molecular Formula C11H12ClN3O5
Exact Mass 301.046548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ErHDc5cRebq
Name 7-CHLORO-1-BETA-D-RIBOFURANOSYLIMIDAZO-[4,5-C]-PYRIDIN-4(5H)-ONE;3-CHLORO-3-DEAZAINOSINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12ClN3O5
InChI InChI=1S/C11H12ClN3O5/c12-4-1-13-10(19)6-7(4)15(3-14-6)11-9(18)8(17)5(2-16)20-11/h1,3,5,8-9,11,16-18H,2H2,(H,13,19)/t5-,8-,9-,11-/m0/s1
InChIKey QTBAJQDKJNPFFG-SDFZTHMVSA-N
Literature Reference Author N.MINAKAWA,N.KOJIMA,A.MATSUDA
Literature Reference Citation J.ORG.CHEM.,64,7158(1999)
Literature Reference DOI 10.1021/jo990638x
Molecular Weight 301.686 g/mol
Sample ID 59448
Solvent DMSO-D6