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N-(1)-[(E)-3--DIHYDROXYPHOSPHONYLPROP-2-ENYL]-THYMINE
SpectraBase Compound ID JL9iz48tVZn
InChI InChI=1S/C8H11N2O5P/c1-6-5-10(8(12)9-7(6)11)3-2-4-16(13,14)15/h2,4-5H,3H2,1H3,(H,9,11,12)(H2,13,14,15)/b4-2+
InChIKey REWSWBWZQAYNHC-DUXPYHPUSA-N
Mol Weight 246.16 g/mol
Molecular Formula C8H11N2O5P
Exact Mass 246.040558 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zXNWZBlj1L
Name N-(1)-[(E)-3--DIHYDROXYPHOSPHONYLPROP-2-ENYL]-THYMINE
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9N2O5P
InChI InChI=1S/C8H11N2O5P/c1-6-5-10(8(12)9-7(6)11)3-2-4-16(13,14)15/h2,4-5H,3H2,1H3,(H,9,11,12)(H2,13,14,15)/b4-2+
InChIKey REWSWBWZQAYNHC-DUXPYHPUSA-N
Literature Reference Author D.TOPALIS,U.PRADERE,V.ROY,C.CAILLAT,A.AZZOUZI,J.BROGGI,R.SNO ECK,G.ANDREI,J.LIN,J
Literature Reference Citation J.MED.CHEM.,54,222(2011)
Literature Reference DOI 10.1021/jm1011462
Solvent CD3OD
Source File Reference UWMZ40578