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acetic acid [(2R,3S,5R)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester
SpectraBase Compound ID 84CnSVuPpEz
InChI InChI=1S/C12H16N2O6/c1-6-4-14(12(18)13-11(6)17)10-3-8(16)9(20-10)5-19-7(2)15/h4,8-10,16H,3,5H2,1-2H3,(H,13,17,18)/t8-,9+,10+/m0/s1
InChIKey ACYSKFODOKGJMA-IVZWLZJFSA-N
Mol Weight 284.27 g/mol
Molecular Formula C12H16N2O6
Exact Mass 284.100836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45AbMtz2UjC
Name acetic acid [(2R,3S,5R)-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N2O6
InChI InChI=1S/C12H16N2O6/c1-6-4-14(12(18)13-11(6)17)10-3-8(16)9(20-10)5-19-7(2)15/h4,8-10,16H,3,5H2,1-2H3,(H,13,17,18)/t8-,9+,10+/m0/s1
InChIKey ACYSKFODOKGJMA-IVZWLZJFSA-N
Literature Reference Author F.MORIS,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,58,653(1993)
Literature Reference DOI 10.1021/jo00055a018
Molecular Weight 284.269 g/mol
Solvent DMSO-D6
Source File Reference UWCS18839