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4-AMINO-7-(2',3'-O-ISOPROPYLIDENE-BETA-D-RIBOFURANOSYL)-5-[1''-(3''-TRIFLUOROACETAMIDO)-PROPYL]-7H-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID 79u1eloD8IB
InChI InChI=1S/C19H24F3N5O5/c1-18(2)31-12-10(7-28)30-16(13(12)32-18)27-6-9(11-14(23)25-8-26-15(11)27)4-3-5-24-17(29)19(20,21)22/h6,8,10,12-13,16,28H,3-5,7H2,1-2H3,(H,24,29)(H2,23,25,26)/t10-,12-,13-,16-/m1/s1
InChIKey LSVZTAXMNVDCGU-XNIJJKJLSA-N
Mol Weight 459.43 g/mol
Molecular Formula C19H24F3N5O5
Exact Mass 459.172953 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ey3XfhlHPfM
Name 4-AMINO-7-(2',3'-O-ISOPROPYLIDENE-BETA-D-RIBOFURANOSYL)-5-[1''-(3''-TRIFLUOROACETAMIDO)-PROPYL]-7H-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24F3N5O5
InChI InChI=1S/C19H24F3N5O5/c1-18(2)31-12-10(7-28)30-16(13(12)32-18)27-6-9(11-14(23)25-8-26-15(11)27)4-3-5-24-17(29)19(20,21)22/h6,8,10,12-13,16,28H,3-5,7H2,1-2H3,(H,24,29)(H2,23,25,26)/t10-,12-,13-,16-/m1/s1
InChIKey LSVZTAXMNVDCGU-XNIJJKJLSA-N
Literature Reference Author F.KUNKEL,R.LURZ,E.WEINHOLD
Literature Reference Citation MOLECULES,20,20805(2015)
Literature Reference DOI 10.3390/molecules201119723
Solvent DMSO-D6
Source File Reference UWPA6110