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1-[2-HYDROXY-1-(HYDROXYMETHYL)-ETHOXYMETHYL]-7-(4-METHYLPHENYL)-THIENO-[3,2-D]-PYRIMIDINE-2,4-DIONE
SpectraBase Compound ID G8ZSd0FP0uv
InChI InChI=1S/C17H18N2O5S/c1-10-2-4-11(5-3-10)13-8-25-15-14(13)19(17(23)18-16(15)22)9-24-12(6-20)7-21/h2-5,8,12,20-21H,6-7,9H2,1H3,(H,18,22,23)
InChIKey BIGWQSKHPICBEN-UHFFFAOYSA-N
Mol Weight 362.4 g/mol
Molecular Formula C17H18N2O5S
Exact Mass 362.093643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4nWiRnobBZ
Name 1-[2-HYDROXY-1-(HYDROXYMETHYL)-ETHOXYMETHYL]-7-(4-METHYLPHENYL)-THIENO-[3,2-D]-PYRIMIDINE-2,4-DIONE
Compound Number 13C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18N2O5S
InChI InChI=1S/C17H18N2O5S/c1-10-2-4-11(5-3-10)13-8-25-15-14(13)19(17(23)18-16(15)22)9-24-12(6-20)7-21/h2-5,8,12,20-21H,6-7,9H2,1H3,(H,18,22,23)
InChIKey BIGWQSKHPICBEN-UHFFFAOYSA-N
Literature Reference Author F.JOURDAN,D.LADUREE,M.ROBBA
Literature Reference Citation J.HETCYCL.CHEM.,31,305(1994)
Literature Reference DOI 10.1002/jhet.5570310208
Molecular Weight 362.400 g/mol
Solvent DMSO-D6
Source File Reference UWCS16762