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1-[(2R,4S,5S)-4-hydroxy-5-methylol-tetrahydrothiophen-2-yl]-5-methyl-pyrimidine-2,4-quinone
SpectraBase Compound ID 64XOUgCql76
InChI InChI=1S/C10H14N2O4S/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7-,8+/m0/s1
InChIKey IVUDHNYLTWOARV-BIIVOSGPSA-N
Mol Weight 258.29 g/mol
Molecular Formula C10H14N2O4S
Exact Mass 258.067428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zzFAqYxVdU
Name 1-[(2R,4S,5S)-4-hydroxy-5-methylol-tetrahydrothiophen-2-yl]-5-methyl-pyrimidine-2,4-quinone
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14N2O4S
InChI InChI=1S/C10H14N2O4S/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7-,8+/m0/s1
InChIKey IVUDHNYLTWOARV-BIIVOSGPSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 258.292 g/mol
Source File Reference MHKO17800