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5-(4-Methoxybenzoyl)-3-methyl-2-(methylthio)pyrimidin-4(3H)-one
SpectraBase Compound ID 6JqbLXT9my1
InChI InChI=1S/C14H14N2O3S/c1-16-13(18)11(8-15-14(16)20-3)12(17)9-4-6-10(19-2)7-5-9/h4-8H,1-3H3
InChIKey JZEMCHVGLJPCGS-UHFFFAOYSA-N
Mol Weight 290.34 g/mol
Molecular Formula C14H14N2O3S
Exact Mass 290.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AS80yRSeir
Name 5-(4-Methoxybenzoyl)-3-methyl-2-(methylthio)pyrimidin-4(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O3S
InChI InChI=1S/C14H14N2O3S/c1-16-13(18)11(8-15-14(16)20-3)12(17)9-4-6-10(19-2)7-5-9/h4-8H,1-3H3
InChIKey JZEMCHVGLJPCGS-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000879
Molecular Weight 290.337 g/mol
SMILES CN1C(SC)=NC=C(C(=O)c2ccc(cc2)OC)C1=O
SPLASH splash10-002u-2890000000-4786047052e4a0730c75
Source of Spectrum U1-2020-5534-4c
Wiley ID 1860922