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3'-(4-CHLOROPHENYL-1,2,3-TRIAZOL-1-YL)-3'-DEOXY-BETA-(E)-5-(2-BROMOVINYL)-2'-DEOXYURIDINE
SpectraBase Compound ID 6YECe1w6p6U
InChI InChI=1S/C19H17BrClN5O4/c20-6-5-12-8-25(19(29)22-18(12)28)17-7-15(16(10-27)30-17)26-9-14(23-24-26)11-1-3-13(21)4-2-11/h1-6,8-9,15-17,27H,7,10H2,(H,22,28,29)/b6-5+/t15-,16+,17+/m1/s1
InChIKey MNYPSYJHVXNBMF-RKOVHHPESA-N
Mol Weight 494.73 g/mol
Molecular Formula C19H17BrClN5O4
Exact Mass 493.015245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5JTZf20QG3
Name 3'-(4-CHLOROPHENYL-1,2,3-TRIAZOL-1-YL)-3'-DEOXY-BETA-(E)-5-(2-BROMOVINYL)-2'-DEOXYURIDINE
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17BrClN5O4
InChI InChI=1S/C19H17BrClN5O4/c20-6-5-12-8-25(19(29)22-18(12)28)17-7-15(16(10-27)30-17)26-9-14(23-24-26)11-1-3-13(21)4-2-11/h1-6,8-9,15-17,27H,7,10H2,(H,22,28,29)/b6-5+/t15-,16+,17+/m1/s1
InChIKey MNYPSYJHVXNBMF-RKOVHHPESA-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 494.732 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46599