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acetic acid [(2R,3R,4R,5R)-2-(acetoxymethyl)-5-(2,4-diketopyrimidin-1-yl)-4-(methylthio)tetrahydrofuran-3-yl] ester

View entire compound with spectra: 1 NMR

acetic acid [(2R,3R,4R,5R)-2-(acetoxymethyl)-5-(2,4-diketopyrimidin-1-yl)-4-(methylthio)tetrahydrofuran-3-yl] ester
SpectraBase Compound ID KBEW6l6V8mS
InChI InChI=1S/C14H18N2O7S/c1-7(17)21-6-9-11(22-8(2)18)12(24-3)13(23-9)16-5-4-10(19)15-14(16)20/h4-5,9,11-13H,6H2,1-3H3,(H,15,19,20)/t9-,11-,12-,13-/m1/s1
InChIKey ZXNMGYHLPJGPBK-OJAKKHQRSA-N
Mol Weight 358.37 g/mol
Molecular Formula C14H18N2O7S
Exact Mass 358.083472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CO7HIGU3bzh
Name acetic acid [(2R,3R,4R,5R)-2-(acetoxymethyl)-5-(2,4-diketopyrimidin-1-yl)-4-(methylthio)tetrahydrofuran-3-yl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18N2O7S
InChI InChI=1S/C14H18N2O7S/c1-7(17)21-6-9-11(22-8(2)18)12(24-3)13(23-9)16-5-4-10(19)15-14(16)20/h4-5,9,11-13H,6H2,1-3H3,(H,15,19,20)/t9-,11-,12-,13-/m1/s1
InChIKey ZXNMGYHLPJGPBK-OJAKKHQRSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 358.366 g/mol
Source File Reference MHKO16563