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2-FLUORO-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT

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2-FLUORO-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT
SpectraBase Compound ID 47Ml5kBB6km
InChI InChI=1S/C10H12FN4O6P.C6H15N/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(21-22(18)19)5(2-16)20-6;1-4-7(5-2)6-3/h3-6,16,22H,1-2H2,(H,18,19)(H,13,14,17);4-6H2,1-3H3/t4-,5+,6+;/m1./s1
InChIKey ZWMGTIRHMWLBFJ-GAJRHLONSA-N
Mol Weight 435.39 g/mol
Molecular Formula C16H27FN5O6P
Exact Mass 435.168299 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KvuFnF0GM0Y
Name 2-FLUORO-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H27FN5O6P
InChI InChI=1S/C10H12FN4O6P.C6H15N/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(21-22(18)19)5(2-16)20-6;1-4-7(5-2)6-3/h3-6,16,22H,1-2H2,(H,18,19)(H,13,14,17);4-6H2,1-3H3/t4-,5+,6+;/m1./s1
InChIKey ZWMGTIRHMWLBFJ-GAJRHLONSA-N
Literature Reference Author C.M.PRUSIEWICZ,R.SANGAIAH,K.B.TOMER,A.GOD
Literature Reference Citation J.ORG.CHEM.,64,7628(1999)
Literature Reference DOI 10.1021/jo982473i
Solvent CD3OH
Source File Reference UWLU60024