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6-Benzyl-3,7,7-trimethyl-2-methoxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 2aKJ7I6WcPP
InChI InChI=1S/C17H22N4O2/c1-17(2)19-14-13(15(22)20(3)16(18-14)23-4)11-21(17)10-12-8-6-5-7-9-12/h5-9,19H,10-11H2,1-4H3
InChIKey YYMJRZZCJLJDHW-UHFFFAOYSA-N
Mol Weight 314.39 g/mol
Molecular Formula C17H22N4O2
Exact Mass 314.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7V3tZ5IW6vG
Name 6-Benzyl-3,7,7-trimethyl-2-methoxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
Appearance Colorless solid
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Formula C17H22N4O2
InChI InChI=1S/C17H22N4O2/c1-17(2)19-14-13(15(22)20(3)16(18-14)23-4)11-21(17)10-12-8-6-5-7-9-12/h5-9,19H,10-11H2,1-4H3
InChIKey YYMJRZZCJLJDHW-UHFFFAOYSA-N
Instrument Name Shimadzu-GCMS 2010-DI-2010 spectrometer
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.653
Molecular Weight 314.389 g/mol
Reported Formula C17H22N4O2
SMILES N1C2=C(CN(C1(C)C)Cc1ccccc1)C(N(C(=N2)OC)C)=O
SPLASH splash10-05mp-5950000000-333fab0a8722becc3708
Source of Spectrum ARK-2014-SM40-4a
Wiley ID 1845609