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2-(METHYLTHIOL)-7-(BETA-D-RIBOFURANOSYL)-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID LUDJXOGGpV9
InChI InChI=1S/C13H14F3N3O4S/c1-24-12-17-9(13(14,15)16)5-2-3-19(10(5)18-12)11-8(22)7(21)6(4-20)23-11/h2-3,6-8,11,20-22H,4H2,1H3/t6-,7-,8-,11-/m1/s1
InChIKey GSALHGSFDSBCLZ-KCGFPETGSA-N
Mol Weight 365.33 g/mol
Molecular Formula C13H14F3N3O4S
Exact Mass 365.065712 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AebwQSdzZtt
Name 2-(METHYLTHIOL)-7-(BETA-D-RIBOFURANOSYL)-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 15F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14F3N3O4S
InChI InChI=1S/C13H14F3N3O4S/c1-24-12-17-9(13(14,15)16)5-2-3-19(10(5)18-12)11-8(22)7(21)6(4-20)23-11/h2-3,6-8,11,20-22H,4H2,1H3/t6-,7-,8-,11-/m1/s1
InChIKey GSALHGSFDSBCLZ-KCGFPETGSA-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
Molecular Weight 365.327 g/mol
Solvent CD3OD
Source File Reference UWIR19272