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DIETHYL-2-[4-[(2-AMINO-6-CHLORO-9H-PURIN-9-YL)-METHYL]-1H-1,2,3-TRIAZOL-1-YL]-ACETAMIDOETHYLPHOSPHONATE
SpectraBase Compound ID HdJczCgpYH5
InChI InChI=1S/C15H21ClN9O4P/c1-3-28-30(27,29-4-2)9-19-11(26)7-25-6-10(22-23-25)5-24-8-18-12-13(16)20-15(17)21-14(12)24/h6,8H,3-5,7,9H2,1-2H3,(H,19,26)(H2,17,20,21)
InChIKey NCLITBYTBPCNHM-UHFFFAOYSA-N
Mol Weight 457.82 g/mol
Molecular Formula C15H21ClN9O4P
Exact Mass 457.114265 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EAPn1kkULiQ
Name DIETHYL-2-[4-[(2-AMINO-6-CHLORO-9H-PURIN-9-YL)-METHYL]-1H-1,2,3-TRIAZOL-1-YL]-ACETAMIDOETHYLPHOSPHONATE
Compound Number 17J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21ClN9O4P
InChI InChI=1S/C15H21ClN9O4P/c1-3-28-30(27,29-4-2)9-19-11(26)7-25-6-10(22-23-25)5-24-8-18-12-13(16)20-15(17)21-14(12)24/h6,8H,3-5,7,9H2,1-2H3,(H,19,26)(H2,17,20,21)
InChIKey NCLITBYTBPCNHM-UHFFFAOYSA-N
Literature Reference Author I.E.GLOWACKA,G.ANDREI,D.SCHOLS,R.SNOECK,D.G.PIOTROWSKA
Literature Reference Citation MOLECULES,20,18789(2015)
Literature Reference DOI 10.3390/molecules201018789
Solvent CDCl3
Source File Reference UWPA5249