John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=DTBQiEv2ana SpectraBase Spectrum ID=9aqeiO7QETw

(accessed ).
9-[2',3'-DIDEOXY-2'-N-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-3'-N-(TRIFLUOROACETYL)-ALPHA-L-THREO-FURANOSYL]-ADENINE
SpectraBase Compound ID DTBQiEv2ana
InChI InChI=1S/C31H28F3N7O3/c1-43-22-14-12-21(13-15-22)30(19-8-4-2-5-9-19,20-10-6-3-7-11-20)40-24-23(39-29(42)31(32,33)34)16-44-28(24)41-18-38-25-26(35)36-17-37-27(25)41/h2-15,17-18,23-24,28,40H,16H2,1H3,(H,39,42)(H2,35,36,37)/t23-,24+,28+/m1/s1
InChIKey IUNZXRYYHBCLLE-NYULUDCUSA-N
Mol Weight 603.61 g/mol
Molecular Formula C31H28F3N7O3
Exact Mass 603.220573 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9aqeiO7QETw
Name 9-[2',3'-DIDEOXY-2'-N-[(4-METHOXYPHENYL)-DIPHENYLMETHYL]-3'-N-(TRIFLUOROACETYL)-ALPHA-L-THREO-FURANOSYL]-ADENINE
Compound Number 34A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28F3N7O3
InChI InChI=1S/C31H28F3N7O3/c1-43-22-14-12-21(13-15-22)30(19-8-4-2-5-9-19,20-10-6-3-7-11-20)40-24-23(39-29(42)31(32,33)34)16-44-28(24)41-18-38-25-26(35)36-17-37-27(25)41/h2-15,17-18,23-24,28,40H,16H2,1H3,(H,39,42)(H2,35,36,37)/t23-,24+,28+/m1/s1
InChIKey IUNZXRYYHBCLLE-NYULUDCUSA-N
Literature Reference Author M.FERENCIC,G.REDDY,X.WU,S.GUNTHA,J.NANDY,R.KRISHNAMURTHY,A.E SCHENMOSER
Literature Reference Citation CHEM.BIODIV.,1,939(2004)
Literature Reference DOI 10.1002/cbdv.200490083
Molecular Weight 603.604 g/mol
Solvent DMSO-D6
Source File Reference UWMS21529
SpectraBase Batch ID 8CFGq0BlRzW