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1-(3,4-DIMETHYLPHENYL)-DIHYDRO-4-(1H,3H)-PYRIMIDINON-2-THIONE

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1-(3,4-DIMETHYLPHENYL)-DIHYDRO-4-(1H,3H)-PYRIMIDINON-2-THIONE
SpectraBase Compound ID FD2vVRDO5gx
InChI InChI=1S/2C12H14N2OS/c2*1-8-3-4-10(7-9(8)2)14-6-5-11(15)13-12(14)16/h2*3-4,7H,5-6H2,1-2H3,(H,13,15,16)
InChIKey ZLWFOBYKALJGEG-UHFFFAOYSA-N
Mol Weight 468.63 g/mol
Molecular Formula C24H28N4O2S2
Exact Mass 468.165369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Dez6ffq9Js
Name 1-(3,4-DIMETHYLPHENYL)-DIHYDRO-4-(1H,3H)-PYRIMIDINON-2-THIONE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H28N4O2S2
InChI InChI=1S/2C12H14N2OS/c2*1-8-3-4-10(7-9(8)2)14-6-5-11(15)13-12(14)16/h2*3-4,7H,5-6H2,1-2H3,(H,13,15,16)
InChIKey ZLWFOBYKALJGEG-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 468.632 g/mol
Sample ID 56905
Solvent DMSO-D6