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[(1S,3R,5S)-3-[2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]-4-METHYLENE-2-OXABICYCLO-[3.1.0]-HEX-1-YL]-METHYL-ACETATE
SpectraBase Compound ID 2wEwTTZb50k
InChI InChI=1S/C13H14N2O5/c1-7-9-5-13(9,6-19-8(2)16)20-11(7)15-4-3-10(17)14-12(15)18/h3-4,9,11H,1,5-6H2,2H3,(H,14,17,18)/t9-,11+,13+/m0/s1
InChIKey XCAKEFCESUGLTO-UFGOTCBOSA-N
Mol Weight 278.26 g/mol
Molecular Formula C13H14N2O5
Exact Mass 278.090272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4wwj8jrhMIc
Name [(1S,3R,5S)-3-[2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]-4-METHYLENE-2-OXABICYCLO-[3.1.0]-HEX-1-YL]-METHYL-ACETATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N2O5
InChI InChI=1S/C13H14N2O5/c1-7-9-5-13(9,6-19-8(2)16)20-11(7)15-4-3-10(17)14-12(15)18/h3-4,9,11H,1,5-6H2,2H3,(H,14,17,18)/t9-,11+,13+/m0/s1
InChIKey XCAKEFCESUGLTO-UFGOTCBOSA-N
Literature Reference Author J.GAGNERON,G.GOSSELIN,C.MATHE
Literature Reference Citation EUR.J.ORG.CHEM.,4891(2006)
Molecular Weight 278.265 g/mol
Sample ID 44334
Solvent DMSO-D6