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ETHYL-AMMONIUM-[2-(ADENIN-9-YL)-ETHOXY]-FLUOROMETHYLPHOSPHONATE

View entire compound with spectra: 2 NMR

ETHYL-AMMONIUM-[2-(ADENIN-9-YL)-ETHOXY]-FLUOROMETHYLPHOSPHONATE
SpectraBase Compound ID 5M1y5Xyem6u
InChI InChI=1S/C10H16FN6O4P/c1-2-20-22(18,21-13)10(11)19-4-3-17-6-16-7-8(12)14-5-15-9(7)17/h5-6,10H,2-4,13H2,1H3,(H2,12,14,15)
InChIKey XSUMESNJKZQYHZ-UHFFFAOYSA-N
Mol Weight 334.25 g/mol
Molecular Formula C10H16FN6O4P
Exact Mass 334.095468 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24flLDmRbdm
Name ETHYL-AMMONIUM-[2-(ADENIN-9-YL)-ETHOXY]-FLUOROMETHYLPHOSPHONATE
Compound Number 30A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H16FN6O4P
InChI InChI=1S/C10H16FN6O4P/c1-2-20-22(18,21-13)10(11)19-4-3-17-6-16-7-8(12)14-5-15-9(7)17/h5-6,10H,2-4,13H2,1H3,(H2,12,14,15)
InChIKey XSUMESNJKZQYHZ-UHFFFAOYSA-N
Literature Reference Author W.CHEN,M.T.FLAVIN,R.FILLER,Z.Q.XU
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3979(1998)
Literature Reference DOI 10.1039/a805929b
Solvent DMSO-D6
Source File Reference UWBS1341