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1-(2,3,5-TRIHYDROXY-BETA-D-RIBOFURANOSYL)-2-THIOXOPYRIMIDIN-4(1H,3H)-ONE
SpectraBase Compound ID 5NqElplUtAE
InChI InChI=1S/C9H12N2O5S/c12-3-4-6(14)7(15)8(16-4)11-2-1-5(13)10-9(11)17/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,17)/t4-,6-,7-,8-/m0/s1
InChIKey GJTBSTBJLVYKAU-PSQAKQOGSA-N
Mol Weight 260.26 g/mol
Molecular Formula C9H12N2O5S
Exact Mass 260.046693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KP6imsmgBME
Name 1-(2,3,5-TRIHYDROXY-BETA-D-RIBOFURANOSYL)-2-THIOXOPYRIMIDIN-4(1H,3H)-ONE
Compound Number 48
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12N2O5S
InChI InChI=1S/C9H12N2O5S/c12-3-4-6(14)7(15)8(16-4)11-2-1-5(13)10-9(11)17/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,17)/t4-,6-,7-,8-/m0/s1
InChIKey GJTBSTBJLVYKAU-PSQAKQOGSA-N
Literature Reference Author A.ROBIN,K.JULIENNE,J.C.MESLIN,D.DENIAUD
Literature Reference Citation EUR.J.ORG.CHEM.,634(2006)
Molecular Weight 260.265 g/mol
Sample ID 43132
Solvent CD3OD