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3'-(4-BUTYL-1,2,3-TRIAZOL-1-YL)-3'-DEOXY-BETA-D-THYMIDINE
SpectraBase Compound ID Fd7yvwxHBjL
InChI InChI=1S/C16H23N5O4/c1-3-4-5-11-8-21(19-18-11)12-6-14(25-13(12)9-22)20-7-10(2)15(23)17-16(20)24/h7-8,12-14,22H,3-6,9H2,1-2H3,(H,17,23,24)/t12-,13+,14?/m0/s1
InChIKey BQPFJKYLPCZFDB-WLDKUNSKSA-N
Mol Weight 349.39 g/mol
Molecular Formula C16H23N5O4
Exact Mass 349.175004 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vgJeFLVaNo
Name 3'-(4-BUTYL-1,2,3-TRIAZOL-1-YL)-3'-DEOXY-BETA-D-THYMIDINE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23N5O4
InChI InChI=1S/C16H23N5O4/c1-3-4-5-11-8-21(19-18-11)12-6-14(25-13(12)9-22)20-7-10(2)15(23)17-16(20)24/h7-8,12-14,22H,3-6,9H2,1-2H3,(H,17,23,24)/t12-,13+,14?/m0/s1
InChIKey BQPFJKYLPCZFDB-WLDKUNSKSA-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 349.390 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46585