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1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-2-(ethylthio)-5-methoxy-pyrimidin-4-one
SpectraBase Compound ID GBSs3T8RrxO
InChI InChI=1S/C12H18N2O6S/c1-3-21-12-13-10(18)6(19-2)4-14(12)11-9(17)8(16)7(5-15)20-11/h4,7-9,11,15-17H,3,5H2,1-2H3/t7-,8-,9-,11-/m1/s1
InChIKey MDMJZMWEVUCHMY-TURQNECASA-N
Mol Weight 318.34 g/mol
Molecular Formula C12H18N2O6S
Exact Mass 318.088557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GEpaAXRJhTZ
Name 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-2-(ethylthio)-5-methoxy-pyrimidin-4-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18N2O6S
InChI InChI=1S/C12H18N2O6S/c1-3-21-12-13-10(18)6(19-2)4-14(12)11-9(17)8(16)7(5-15)20-11/h4,7-9,11,15-17H,3,5H2,1-2H3/t7-,8-,9-,11-/m1/s1
InChIKey MDMJZMWEVUCHMY-TURQNECASA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 318.345 g/mol
Source File Reference MHKO10010