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1-(2,3-DIDEOXY-3-FLUORO-5-O-(4-PHENYLBENZOYL)-BETA-D-ERYTHRO-PENTOFURANOSYL)-2-METHYLTHIOPYRIMIDIN-4(1H)-ONE
SpectraBase Compound ID 3XBFYizQYwC
InChI InChI=1S/C23H21FN2O4S/c1-31-23-25-20(27)11-12-26(23)21-13-18(24)19(30-21)14-29-22(28)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-12,18-19,21H,13-14H2,1H3/t18-,19+,21+/m0/s1
InChIKey IJCSDFWMAYLHRM-QKNQBKEWSA-N
Mol Weight 440.49 g/mol
Molecular Formula C23H21FN2O4S
Exact Mass 440.120606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EIZQDaGXHlJ
Name 1-(2,3-DIDEOXY-3-FLUORO-5-O-(4-PHENYLBENZOYL)-BETA-D-ERYTHRO-PENTOFURANOSYL)-2-METHYLTHIOPYRIMIDIN-4(1H)-ONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21FN2O4S
InChI InChI=1S/C23H21FN2O4S/c1-31-23-25-20(27)11-12-26(23)21-13-18(24)19(30-21)14-29-22(28)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-12,18-19,21H,13-14H2,1H3/t18-,19+,21+/m0/s1
InChIKey IJCSDFWMAYLHRM-QKNQBKEWSA-N
Literature Reference Author M.A.ZAHRAN,A.E.S.ABDEL-MEGIED,A.A.H.ABDEL-RAHMAN,M.A.SOFAN,C .NIELSEN,E.B.PEDERS
Literature Reference Citation MH.CHEM.,127,979(1996)
Literature Reference DOI 10.1007/BF00807039
Molecular Weight 440.489 g/mol
Solvent CDCl3
Source File Reference UWMZ337