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2,3-DIHYDRO-5-ISOPROPYL-6-(THIEN-2-YL-METHYL)-2-THIOXOPYRIMIDIN-4(1H)-ONE
SpectraBase Compound ID JkBSQP18fZr
InChI InChI=1S/C12H14N2OS2/c1-7(2)10-9(6-8-4-3-5-17-8)13-12(16)14-11(10)15/h3-5,7H,6H2,1-2H3,(H2,13,14,15,16)
InChIKey ZJZAXURZXHRKAV-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C12H14N2OS2
Exact Mass 266.054755 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FtNLXPKqji4
Name 2,3-DIHYDRO-5-ISOPROPYL-6-(THIEN-2-YL-METHYL)-2-THIOXOPYRIMIDIN-4(1H)-ONE
Compound Number 4F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2OS2
InChI InChI=1S/C12H14N2OS2/c1-7(2)10-9(6-8-4-3-5-17-8)13-12(16)14-11(10)15/h3-5,7H,6H2,1-2H3,(H2,13,14,15,16)
InChIKey ZJZAXURZXHRKAV-UHFFFAOYSA-N
Literature Reference Author O.S.PEDERSEN,L.PETERSEN,M.BRANDT,C.NIELSEN,E.B.PEDERSEN
Literature Reference Citation MH.CHEM.,130,1499(1999)
Literature Reference DOI 10.1007/s007060050310
Molecular Weight 266.376 g/mol
Solvent DMSO-D6
Source File Reference UWCS25482