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1-(2-METHOXYPHENYL)-5-METHYLDIHYDRO-4(1H,3H)-PYRIMIDINON-2-THIONE (C-NISOMER 1)
SpectraBase Compound ID 7yiAOTlbvcu
InChI InChI=1S/C12H14N2O2S/c1-8-7-14(12(17)13-11(8)15)9-5-3-4-6-10(9)16-2/h3-6,8H,7H2,1-2H3,(H,13,15,17)
InChIKey OATPKXFBVODQMQ-UHFFFAOYSA-N
Mol Weight 250.32 g/mol
Molecular Formula C12H14N2O2S
Exact Mass 250.077599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LbVmfxPIOP7
Name 1-(2-METHOXYPHENYL)-5-METHYLDIHYDRO-4(1H,3H)-PYRIMIDINON-2-THIONE (C-NISOMER 1)
Comments xeÐ
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Formula C12H14N2O2S
InChI InChI=1S/C12H14N2O2S/c1-8-7-14(12(17)13-11(8)15)9-5-3-4-6-10(9)16-2/h3-6,8H,7H2,1-2H3,(H,13,15,17)
InChIKey OATPKXFBVODQMQ-UHFFFAOYSA-N
Instrument Name Bruker WM-360
Literature Reference V.YU.MITSKYAVICHUS, R.S.BALTRUSHITS, I.CH.BILISKAITE, E.E.LIEPIN'SH,R.M.ZOLOTOYABKO (1991) Khim.Heteroc.Soed.(Russ. Lang.): N9, 1240-1247.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo