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2,4-Dioxo-8-(tri-O-benzyl.beta.-D-ribofuranosyl)-pyrazolo-1,3,5-triazine
SpectraBase Compound ID Hm1KNnUWVsP
InChI InChI=1S/C31H30N4O6/c36-30-33-29-24(16-32-35(29)31(37)34-30)26-28(40-19-23-14-8-3-9-15-23)27(39-18-22-12-6-2-7-13-22)25(41-26)20-38-17-21-10-4-1-5-11-21/h1-16,25-28H,17-20H2,(H2,33,34,36,37)
InChIKey QNJMBWRIROBPLA-UHFFFAOYSA-N
Mol Weight 554.6 g/mol
Molecular Formula C31H30N4O6
Exact Mass 554.216535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IzfjJM6y7A0
Name 2,4-Dioxo-8-(tri-O-benzyl.beta.-D-ribofuranosyl)-pyrazolo-1,3,5-triazine
CAS Registry Number 59464-09-4
Comments FOR BENZYL CARBONS ONLY AVERAGED VALUES
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H30N4O6
InChI InChI=1S/C31H30N4O6/c36-30-33-29-24(16-32-35(29)31(37)34-30)26-28(40-19-23-14-8-3-9-15-23)27(39-18-22-12-6-2-7-13-22)25(41-26)20-38-17-21-10-4-1-5-11-21/h1-16,25-28H,17-20H2,(H2,33,34,36,37)
InChIKey QNJMBWRIROBPLA-UHFFFAOYSA-N
Literature Reference C.M. Gupta, G.H. Jones, J.G.Mofatt, J. Org. Chem. 41, 3000 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3