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2',3'-DI-O-ACETYL-5'-R-FLUORO-5'-S-PHENYL-5'-THIOADENOSINE
SpectraBase Compound ID BK5CDDxmnYl
InChI InChI=1S/C20H20FN5O5S/c1-10(27)29-14-15(17(21)32-12-6-4-3-5-7-12)31-20(16(14)30-11(2)28)26-9-25-13-18(22)23-8-24-19(13)26/h3-9,14-17,20H,1-2H3,(H2,22,23,24)/t14-,15+,16-,17+,20-/m0/s1
InChIKey WXWUNSRTBISWJG-PHSQPZKOSA-N
Mol Weight 461.47 g/mol
Molecular Formula C20H20FN5O5S
Exact Mass 461.116918 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Chiw8P6HEbi
Name 2',3'-DI-O-ACETYL-5'-R-FLUORO-5'-S-PHENYL-5'-THIOADENOSINE
Compound Number 4A-(5'-R)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20FN5O5S
InChI InChI=1S/C20H20FN5O5S/c1-10(27)29-14-15(17(21)32-12-6-4-3-5-7-12)31-20(16(14)30-11(2)28)26-9-25-13-18(22)23-8-24-19(13)26/h3-9,14-17,20H,1-2H3,(H2,22,23,24)/t14-,15+,16-,17+,20-/m0/s1
InChIKey WXWUNSRTBISWJG-PHSQPZKOSA-N
Literature Reference Author M.J.ROBINS,S.F.WNUK,K.B.MULLAH,N.K.DALLEY,C.S.YUAN,Y.LEE,R.T .BORCHARDT
Literature Reference Citation J.ORG.CHEM.,59,544(1994)
Literature Reference DOI 10.1021/jo00082a010
Solvent DMSO-D6
Source File Reference UWMZ2435