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5'-O-(4,4'-DIMETHOXYTRITYL)-2-FLUORO-O(6)-BENZYL-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT

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5'-O-(4,4'-DIMETHOXYTRITYL)-2-FLUORO-O(6)-BENZYL-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT
SpectraBase Compound ID HD5mgDAEw0I
InChI InChI=1S/C38H34FN4O9P.C6H15N/c1-47-28-17-13-26(14-18-28)38(25-11-7-4-8-12-25,27-15-19-29(48-2)20-16-27)49-22-31-30(52-53(45)46)21-32(50-31)43-23-40-33-34(43)41-37(39)42-35(33)51-36(44)24-9-5-3-6-10-24;1-4-7(5-2)6-3/h3-20,23,30-32,53H,21-22H2,1-2H3,(H,45,46);4-6H2,1-3H3/t30-,31+,32+;/m0./s1
InChIKey DKWWUINHJAABIP-SNGUFSSQSA-N
Mol Weight 841.9 g/mol
Molecular Formula C44H49FN5O9P
Exact Mass 841.325193 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxBcu10avRM
Name 5'-O-(4,4'-DIMETHOXYTRITYL)-2-FLUORO-O(6)-BENZYL-2'-DEOXYINOSINE-3'-H-PHOSPHONATE-TRIETHYLAMMONIUM-SALT
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H49FN5O9P
InChI InChI=1S/C38H34FN4O9P.C6H15N/c1-47-28-17-13-26(14-18-28)38(25-11-7-4-8-12-25,27-15-19-29(48-2)20-16-27)49-22-31-30(52-53(45)46)21-32(50-31)43-23-40-33-34(43)41-37(39)42-35(33)51-36(44)24-9-5-3-6-10-24;1-4-7(5-2)6-3/h3-20,23,30-32,53H,21-22H2,1-2H3,(H,45,46);4-6H2,1-3H3/t30-,31+,32+;/m0./s1
InChIKey DKWWUINHJAABIP-SNGUFSSQSA-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 C5D5N:DIOXANE
Source File Reference UWLU60022