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(1S,3R,5R,6R,8R)-5-HYDROXY-3,6-BIS-(HYDROXYMETHYL)-8-(THYMIN-1-YL)-2,7-DIOXABICYCLO-[3.3.0]-OCTANE
SpectraBase Compound ID EDO1YYAnyJy
InChI InChI=1S/C13H18N2O7/c1-6-3-15(12(19)14-10(6)18)11-9-13(20,8(5-17)22-11)2-7(4-16)21-9/h3,7-9,11,16-17,20H,2,4-5H2,1H3,(H,14,18,19)/t7-,8-,9-,11-,13-/m0/s1
InChIKey FMVUREKMIRQWMH-HUWMYRJZSA-N
Mol Weight 314.29 g/mol
Molecular Formula C13H18N2O7
Exact Mass 314.111401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CTBahAfciKM
Name (1S,3R,5R,6R,8R)-5-HYDROXY-3,6-BIS-(HYDROXYMETHYL)-8-(THYMIN-1-YL)-2,7-DIOXABICYCLO-[3.3.0]-OCTANE
Compound Number 10R
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N2O7
InChI InChI=1S/C13H18N2O7/c1-6-3-15(12(19)14-10(6)18)11-9-13(20,8(5-17)22-11)2-7(4-16)21-9/h3,7-9,11,16-17,20H,2,4-5H2,1H3,(H,14,18,19)/t7-,8-,9-,11-,13-/m0/s1
InChIKey FMVUREKMIRQWMH-HUWMYRJZSA-N
Literature Reference Author M.RAUNKJAER,C.E.OLSEN,J.WENGEL
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2543(1999)
Molecular Weight 314.295 g/mol
Solvent DMSO-D6
Source File Reference UWGE3726