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5-(Benzoyl)-3-ethyl-2-(methylthio)pyrimidin-4(3H)-one
SpectraBase Compound ID 10goNTHOPcJ
InChI InChI=1S/C14H14N2O2S/c1-3-16-13(18)11(9-15-14(16)19-2)12(17)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey SGPOLGWUWVHCCA-UHFFFAOYSA-N
Mol Weight 274.34 g/mol
Molecular Formula C14H14N2O2S
Exact Mass 274.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KJXlxclrE
Name 5-(Benzoyl)-3-ethyl-2-(methylthio)pyrimidin-4(3H)-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2S
InChI InChI=1S/C14H14N2O2S/c1-3-16-13(18)11(9-15-14(16)19-2)12(17)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey SGPOLGWUWVHCCA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000879
Molecular Weight 274.338 g/mol
SMILES C(N1C(SC)=NC=C(C(=O)c2ccccc2)C1=O)C
SPLASH splash10-0600-0960000000-164f4bb5377cdad9df10
Source of Spectrum U1-2020-5535-5a
Wiley ID 1860927