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2-(ethylthio)-5-methyl-6-veratryl-1H-pyrimidin-4-one
SpectraBase Compound ID Fyu3F0Wjwu4
InChI InChI=1S/C16H20N2O3S/c1-5-22-16-17-12(10(2)15(19)18-16)8-11-6-7-13(20-3)14(9-11)21-4/h6-7,9H,5,8H2,1-4H3,(H,17,18,19)
InChIKey XLWAJRMSOJTIQY-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C16H20N2O3S
Exact Mass 320.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRUoALcuEjP
Name 2-(ethylthio)-5-methyl-6-veratryl-1H-pyrimidin-4-one
Alternate Name(s) 6-[(3,4-dimethoxyphenyl)methyl]-2-(ethylthio)-5-methyl-1H-pyrimidin-4-one 6-[(3,4-dimethoxyphenyl)methyl]-2-ethylsulfanyl-5-methyl-1H-pyrimidin-4-one
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Formula C16H20N2O3S
InChI InChI=1S/C16H20N2O3S/c1-5-22-16-17-12(10(2)15(19)18-16)8-11-6-7-13(20-3)14(9-11)21-4/h6-7,9H,5,8H2,1-4H3,(H,17,18,19)
InChIKey XLWAJRMSOJTIQY-UHFFFAOYSA-N
Molecular Weight 320.407 g/mol
SMILES N1C(=NC(=C(C1=O)C)Cc1cc(OC)c(cc1)OC)SCC
SPLASH splash10-00di-0129000000-ee0a2e8e1cee9348b508
Source of Spectrum SK-32-1372-4
Wiley ID 1548717