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3,7-Dimethyl-2-(methylthio)-6-phenyl-5,6-dihydropyrimido[4,5-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 2ZK3jZ2cxEv
InChI InChI=1S/C15H16N4OS/c1-10-16-13-12(14(20)18(2)15(17-13)21-3)9-19(10)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey PFUPRFUPSYISOF-UHFFFAOYSA-N
Mol Weight 300.38 g/mol
Molecular Formula C15H16N4OS
Exact Mass 300.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L08TBpSMXN8
Name 3,7-Dimethyl-2-(methylthio)-6-phenyl-5,6-dihydropyrimido[4,5-d]pyrimidin-4(3H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N4OS
InChI InChI=1S/C15H16N4OS/c1-10-16-13-12(14(20)18(2)15(17-13)21-3)9-19(10)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey PFUPRFUPSYISOF-UHFFFAOYSA-N
Instrument Name Shimadzu-GCMS 2010-DI-2010 spectrometer
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.653
Molecular Weight 300.380 g/mol
Reported Formula C15H16N4OS
SMILES CC=1N(CC2=C(N=C(N(C2=O)C)SC)N1)c1ccccc1
SPLASH splash10-05mn-9440000000-368264ca7f02eb8e864f
Source of Spectrum ARK-2014-SM37-3e
Wiley ID 1845604