John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9DxEQshy5ri SpectraBase Spectrum ID=GxyvABdmuyW

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2-AMINO-7-(BETA-D-RIBOFURANOSYL)-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID 9DxEQshy5ri
InChI InChI=1S/C12H13F3N4O4/c13-12(14,15)8-4-1-2-19(9(4)18-11(16)17-8)10-7(22)6(21)5(3-20)23-10/h1-2,5-7,10,20-22H,3H2,(H2,16,17,18)/t5-,6-,7-,10-/m1/s1
InChIKey WTJIGQPFNGTMFL-DAGMQNCNSA-N
Mol Weight 334.26 g/mol
Molecular Formula C12H13F3N4O4
Exact Mass 334.08889 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GxyvABdmuyW
Name 2-AMINO-7-(BETA-D-RIBOFURANOSYL)-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 15H
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13F3N4O4
InChI InChI=1S/C12H13F3N4O4/c13-12(14,15)8-4-1-2-19(9(4)18-11(16)17-8)10-7(22)6(21)5(3-20)23-10/h1-2,5-7,10,20-22H,3H2,(H2,16,17,18)/t5-,6-,7-,10-/m1/s1
InChIKey WTJIGQPFNGTMFL-DAGMQNCNSA-N
Literature Reference Author J.DREXLER,U.GROTH
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6314(2014)
Literature Reference DOI 10.1002/ejoc.201402755
Solvent CD3OD
Source File Reference UWIR19274
SpectraBase Batch ID Jx8hvXSwTdK