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[2-(13)C-1,3-(15)N2]-6-CHLORO-9-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-PURINE
SpectraBase Compound ID AfWTT8maBVy
InChI InChI=1S/C10H11ClN4O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2/t5-,6+,7+/m0/s1/i3+1,12+1,13+1
InChIKey PGEULCIODBNODW-NQQZJJEMSA-N
Mol Weight 273.65 g/mol
Molecular Formula C913CH11ClN215N2O3
Exact Mass 273.049393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cs832BcZZrt
Name [2-(13)C-1,3-(15)N2]-6-CHLORO-9-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-PURINE
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
InChI InChI=1S/C10H11ClN4O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2/t5-,6+,7+/m0/s1/i3+1,12+1,13+1
InChIKey PGEULCIODBNODW-NQQZJJEMSA-N
Literature Reference Author J.L.ABAD,B.L.GAFFNEY,R.A.JONES
Literature Reference Citation J.ORG.CHEM.,64,6575(1999)
Literature Reference DOI 10.1021/jo982372k
Molecular Weight 272.662 g/mol
Sample ID 59439
Solvent DMSO-D6