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(1S,5R,6S)-6-BENZYLOXY-5-BENZOYLOXYMETHYL-1-(URACIL-1-YL)-3,8-DIOXABICYCLO-[3.2.1]-OCTANE
SpectraBase Compound ID JcIGlT8UOxa
InChI InChI=1S/C25H24N2O7/c28-21-11-12-27(23(30)26-21)25-13-20(32-14-18-7-3-1-4-8-18)24(34-25,15-31-17-25)16-33-22(29)19-9-5-2-6-10-19/h1-12,20H,13-17H2,(H,26,28,30)/t20-,24+,25-/m1/s1
InChIKey DSDADFULGDMCPI-DCEDVJGZSA-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 KLPQZ1gtdGS
Name (1S,5R,6S)-6-BENZYLOXY-5-BENZOYLOXYMETHYL-1-(URACIL-1-YL)-3,8-DIOXABICYCLO-[3.2.1]-OCTANE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24N2O7
InChI InChI=1S/C25H24N2O7/c28-21-11-12-27(23(30)26-21)25-13-20(32-14-18-7-3-1-4-8-18)24(34-25,15-31-17-25)16-33-22(29)19-9-5-2-6-10-19/h1-12,20H,13-17H2,(H,26,28,30)/t20-,24+,25-/m1/s1
InChIKey DSDADFULGDMCPI-DCEDVJGZSA-N
Literature Reference Author L.KVAERNO,J.WENGEL
Literature Reference Citation J.ORG.CHEM.,66,5498(2001)
Literature Reference DOI 10.1021/jo015664l
Molecular Weight 464.475 g/mol
Solvent CDCl3
Source File Reference UWLU27281