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6-Benzyl-2-methoxy-3,9-dimethyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
SpectraBase Compound ID FU8t3OlKPae
InChI InChI=1S/C17H20N4O3/c1-19-11-14(22)21(9-12-7-5-4-6-8-12)10-13-15(19)18-17(24-3)20(2)16(13)23/h4-8H,9-11H2,1-3H3
InChIKey DSIBVGYXNGYHJV-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C17H20N4O3
Exact Mass 328.153541 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAZqlryJdNe
Name 6-Benzyl-2-methoxy-3,9-dimethyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
Appearance Yellow solid
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Formula C17H20N4O3
InChI InChI=1S/C17H20N4O3/c1-19-11-14(22)21(9-12-7-5-4-6-8-12)10-13-15(19)18-17(24-3)20(2)16(13)23/h4-8H,9-11H2,1-3H3
InChIKey DSIBVGYXNGYHJV-UHFFFAOYSA-N
Instrument Name SHIMADZU 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2016.07.012
Molecular Weight 328.372 g/mol
Reported Formula C17H20N4O3
SMILES C=1(N(C(C2=C(N1)N(CC(N(C2)Cc1ccccc1)=O)C)=O)C)OC
SPLASH splash10-000l-2983000000-6006457c8a11551e15d0
Source of Spectrum AJC-12-SM127-11b
Wiley ID 1857357