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DITHYMIDYLYL-3',5'-PHOSPHOROTHIOFLUORIDATE
SpectraBase Compound ID KUSnaYIJdDJ
InChI InChI=1S/2C20H26FN4O10PS/c2*1-9-5-24(19(30)22-17(9)28)15-3-11(27)14(34-15)8-32-36(21,37)35-12-4-16(33-13(12)7-26)25-6-10(2)18(29)23-20(25)31/h2*5-6,11-16,26-27H,3-4,7-8H2,1-2H3,(H,22,28,30)(H,23,29,31)/t2*11-,12+,13-,14+,15+,16-,36?/m00/s1
InChIKey ICPOISXZQQZSEM-DDNZWLPNSA-N
Mol Weight 1128.96 g/mol
Molecular Formula C40H52F2N8O20P2S2
Exact Mass 1128.218259 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6XtNaJZNd6A
Name DITHYMIDYLYL-3',5'-PHOSPHOROTHIOFLUORIDATE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H52F2N8O20P2S2
InChI InChI=1S/2C20H26FN4O10PS/c2*1-9-5-24(19(30)22-17(9)28)15-3-11(27)14(34-15)8-32-36(21,37)35-12-4-16(33-13(12)7-26)25-6-10(2)18(29)23-20(25)31/h2*5-6,11-16,26-27H,3-4,7-8H2,1-2H3,(H,22,28,30)(H,23,29,31)/t2*11-,12+,13-,14+,15+,16-,36?/m00/s1
InChIKey ICPOISXZQQZSEM-DDNZWLPNSA-N
Literature Reference Author K.MISIURA,D.SZYMANOWICZ,H.KUSNIERCZYK
Literature Reference Citation BIOORG.MED.CHEM.,9,1525(2001)
Literature Reference DOI 10.1016/S0968-0896(01)00025-6
Solvent CDCl3:C2H5OH=3:1
Source File Reference UWSI21104