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1-(3,6-DI-O-BENZOYL-2,4-DIDEOXY-ALPHA-D-ERYTHRO-HEXO-PYRANOSYL)-THYMINE
SpectraBase Compound ID ICmFgM6kvIo
InChI InChI=1S/C25H24N2O7/c1-16-14-27(25(31)26-22(16)28)21-13-19(34-24(30)18-10-6-3-7-11-18)12-20(33-21)15-32-23(29)17-8-4-2-5-9-17/h2-11,14,19-21H,12-13,15H2,1H3,(H,26,28,31)/t19-,20+,21+/m0/s1
InChIKey ZBHIRFGVQZZEFA-PWRODBHTSA-N
Mol Weight 464.47 g/mol
Molecular Formula C25H24N2O7
Exact Mass 464.158351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9agHXvF4nNX
Name 1-(3,6-DI-O-BENZOYL-2,4-DIDEOXY-ALPHA-D-ERYTHRO-HEXO-PYRANOSYL)-THYMINE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24N2O7
InChI InChI=1S/C25H24N2O7/c1-16-14-27(25(31)26-22(16)28)21-13-19(34-24(30)18-10-6-3-7-11-18)12-20(33-21)15-32-23(29)17-8-4-2-5-9-17/h2-11,14,19-21H,12-13,15H2,1H3,(H,26,28,31)/t19-,20+,21+/m0/s1
InChIKey ZBHIRFGVQZZEFA-PWRODBHTSA-N
Literature Reference Author K.AUGUSTYNS,J.ROZENSKI,A.VANAERSCHOT,G.JANSSEN,P.HERDEWIJN
Literature Reference Citation J.ORG.CHEM.,58,2977(1993)
Literature Reference DOI 10.1021/jo00063a013
Molecular Weight 464.475 g/mol
Solvent CDCl3
Source File Reference UWRU770