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2',3'-DI-O-ACETYL-5-DEOXY-5-(FLUOROMETHYLTHIO)ADENOSINE
SpectraBase Compound ID 40TQUgmtABU
InChI InChI=1S/C15H18FN5O5S/c1-7(22)24-11-9(3-27-4-16)26-15(12(11)25-8(2)23)21-6-20-10-13(17)18-5-19-14(10)21/h5-6,9,11-12,15H,3-4H2,1-2H3,(H2,17,18,19)/t9-,11-,12-,15-/m1/s1
InChIKey MHKHANOAWVIKDF-SDBHATRESA-N
Mol Weight 399.4 g/mol
Molecular Formula C15H18FN5O5S
Exact Mass 399.101268 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F8iotbezfmS
Name 2',3'-DI-O-ACETYL-5-DEOXY-5-(FLUOROMETHYLTHIO)ADENOSINE
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Formula C15H18FN5O5S
InChI InChI=1S/C15H18FN5O5S/c1-7(22)24-11-9(3-27-4-16)26-15(12(11)25-8(2)23)21-6-20-10-13(17)18-5-19-14(10)21/h5-6,9,11-12,15H,3-4H2,1-2H3,(H2,17,18,19)/t9-,11-,12-,15-/m1/s1
InChIKey MHKHANOAWVIKDF-SDBHATRESA-N
Instrument Name Varian EM-390
Literature Reference JANICE R. SUFRIN, ARTHUR J. SPIESS, VITAUTS ALKS (1990) J.Fluor.Chem.: v.49, N2,177-182.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d