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3-Methyl-2-(methylthio)-6-phenyl-5,6-dihydropyrimido[4,5-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 70SuhaDiXGl
InChI InChI=1S/C14H14N4OS/c1-17-13(19)11-8-18(10-6-4-3-5-7-10)9-15-12(11)16-14(17)20-2/h3-7,9H,8H2,1-2H3
InChIKey NVJOOZZFVFSDHD-UHFFFAOYSA-N
Mol Weight 286.35 g/mol
Molecular Formula C14H14N4OS
Exact Mass 286.088832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K46gzc2SieL
Name 3-Methyl-2-(methylthio)-6-phenyl-5,6-dihydropyrimido[4,5-d]pyrimidin-4(3H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N4OS
InChI InChI=1S/C14H14N4OS/c1-17-13(19)11-8-18(10-6-4-3-5-7-10)9-15-12(11)16-14(17)20-2/h3-7,9H,8H2,1-2H3
InChIKey NVJOOZZFVFSDHD-UHFFFAOYSA-N
Instrument Name Shimadzu-GCMS 2010-DI-2010 spectrometer
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.653
Molecular Weight 286.353 g/mol
Reported Formula C14H14N4OS
SMILES CN1C(=NC2=C(C1=O)CN(C=N2)c1ccccc1)SC
SPLASH splash10-0f9i-9240000000-c354b9bf2ef5ffa431a8
Source of Spectrum ARK-2014-SM37-3d
Wiley ID 1845603