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5'-FLUORO-5'-S-PHENYL-5'-THIOADENOSINE;MIXTURE_OF_5'-R_AND_5'-S

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5'-FLUORO-5'-S-PHENYL-5'-THIOADENOSINE;MIXTURE_OF_5'-R_AND_5'-S
SpectraBase Compound ID FAHJ7ZgYszl
InChI InChI=1S/2C16H16FN5O3S/c2*17-13(26-8-4-2-1-3-5-8)12-10(23)11(24)16(25-12)22-7-21-9-14(18)19-6-20-15(9)22/h2*1-7,10-13,16,23-24H,(H2,18,19,20)/t2*10-,11+,12-,13-,16+/m10/s1
InChIKey MJMGAZIJMIGLPB-HRINHKKPSA-N
Mol Weight 754.79 g/mol
Molecular Formula C32H32F2N10O6S2
Exact Mass 754.191577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NnvtLoRKRK
Name 5'-FLUORO-5'-S-PHENYL-5'-THIOADENOSINE;MIXTURE_OF_5'-R_AND_5'-S
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H32F2N10O6S2
InChI InChI=1S/2C16H16FN5O3S/c2*17-13(26-8-4-2-1-3-5-8)12-10(23)11(24)16(25-12)22-7-21-9-14(18)19-6-20-15(9)22/h2*1-7,10-13,16,23-24H,(H2,18,19,20)/t2*10-,11+,12-,13-,16+/m10/s1
InChIKey MJMGAZIJMIGLPB-HRINHKKPSA-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
Molecular Weight 754.786 g/mol
Solvent DMSO-D6
Source File Reference UWMZ2456