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3-BROMO-1-(5-O-BENZOYL-2-DEOXY-2-FLUORO-BETA-D-ARABINOFURANOSYL)-4-ISOPROPOXY-1H-PYRAZOLO-[3.4-D]-PYRIMIDIN-6-AMINE
SpectraBase Compound ID 91MOpRDkqiz
InChI InChI=1S/C20H21BrFN5O5/c1-9(2)31-17-12-15(21)26-27(16(12)24-20(23)25-17)18-13(22)14(28)11(32-18)8-30-19(29)10-6-4-3-5-7-10/h3-7,9,11,13-14,18,28H,8H2,1-2H3,(H2,23,24,25)/t11-,13+,14-,18-/m1/s1
InChIKey MORIAOJZCMPOAP-BFPDHSSHSA-N
Mol Weight 510.32 g/mol
Molecular Formula C20H21BrFN5O5
Exact Mass 509.07101 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1imog3Oi7J
Name 3-BROMO-1-(5-O-BENZOYL-2-DEOXY-2-FLUORO-BETA-D-ARABINOFURANOSYL)-4-ISOPROPOXY-1H-PYRAZOLO-[3.4-D]-PYRIMIDIN-6-AMINE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21BrFN5O5
InChI InChI=1S/C20H21BrFN5O5/c1-9(2)31-17-12-15(21)26-27(16(12)24-20(23)25-17)18-13(22)14(28)11(32-18)8-30-19(29)10-6-4-3-5-7-10/h3-7,9,11,13-14,18,28H,8H2,1-2H3,(H2,23,24,25)/t11-,13+,14-,18-/m1/s1
InChIKey MORIAOJZCMPOAP-BFPDHSSHSA-N
Literature Reference Author J.HE,I.MIKHAILOPULO,F.SEELA
Literature Reference Citation J.ORG.CHEM.,68,5519(2003)
Literature Reference DOI 10.1021/jo030051p
Solvent DMSO-D6
Source File Reference UWVN25341