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3'-DEOXY-3'-(5-PHENYL-1,2,3-TRIAZOL-1-YL)-BETA-D-THYMIDINE
SpectraBase Compound ID BF9PO8gsFMH
InChI InChI=1S/C18H19N5O4/c1-11-9-22(18(26)20-17(11)25)16-7-13(15(10-24)27-16)23-14(8-19-21-23)12-5-3-2-4-6-12/h2-6,8-9,13,15-16,24H,7,10H2,1H3,(H,20,25,26)/t13-,15+,16+/m1/s1
InChIKey ZGLKLXLPRAAAMO-KBMXLJTQSA-N
Mol Weight 369.38 g/mol
Molecular Formula C18H19N5O4
Exact Mass 369.143704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 67TKcgj8HqB
Name 3'-DEOXY-3'-(5-PHENYL-1,2,3-TRIAZOL-1-YL)-BETA-D-THYMIDINE
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19N5O4
InChI InChI=1S/C18H19N5O4/c1-11-9-22(18(26)20-17(11)25)16-7-13(15(10-24)27-16)23-14(8-19-21-23)12-5-3-2-4-6-12/h2-6,8-9,13,15-16,24H,7,10H2,1H3,(H,20,25,26)/t13-,15+,16+/m1/s1
InChIKey ZGLKLXLPRAAAMO-KBMXLJTQSA-N
Literature Reference Author S.VANPOECKE,A.NEGRI,F.GAGO,I.VANDAELE,N.SOLAROLI,A.KARLSSON, J.BALZARINI,S.VANCAL
Literature Reference Citation J.MED.CHEM.,53,2902(2010)
Literature Reference DOI 10.1021/jm901532h
Molecular Weight 369.380 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46592