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1-(3,5-DIMETHYLPHENYL)-DIHYDRO-4-(1H,3H)-PYRIMIDINON-2-THIONE
SpectraBase Compound ID LOPtqFxnpWC
InChI InChI=1S/C12H14N2OS/c1-8-5-9(2)7-10(6-8)14-4-3-11(15)13-12(14)16/h5-7H,3-4H2,1-2H3,(H,13,15,16)
InChIKey DKSHYRZUUAHRRZ-UHFFFAOYSA-N
Mol Weight 234.32 g/mol
Molecular Formula C12H14N2OS
Exact Mass 234.082684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9KjaDU8tJ9E
Name 1-(3,5-DIMETHYLPHENYL)-DIHYDRO-4-(1H,3H)-PYRIMIDINON-2-THIONE
Compound Number 13C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2OS
InChI InChI=1S/C12H14N2OS/c1-8-5-9(2)7-10(6-8)14-4-3-11(15)13-12(14)16/h5-7H,3-4H2,1-2H3,(H,13,15,16)
InChIKey DKSHYRZUUAHRRZ-UHFFFAOYSA-N
Literature Reference Author R.VAICKELIONIENE,V.MICKEVICIUS,G.MIKULSKIENE
Literature Reference Citation MOLECULES,10,407(2005)
Literature Reference DOI 10.3390/10020407
Molecular Weight 234.316 g/mol
Sample ID 56906
Solvent DMSO-D6