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2-Methoxy-3,8-dimethyl-6-phenyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
SpectraBase Compound ID KSSzt2QhcrC
InChI InChI=1S/C16H18N4O3/c1-10-14(21)20(11-7-5-4-6-8-11)9-12-13(17-10)18-16(23-3)19(2)15(12)22/h4-8,10,17H,9H2,1-3H3
InChIKey CVLPYGWYGQIWSQ-UHFFFAOYSA-N
Mol Weight 314.35 g/mol
Molecular Formula C16H18N4O3
Exact Mass 314.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Jp4iW2sCDg
Name 2-Methoxy-3,8-dimethyl-6-phenyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
Appearance Colourless solid
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Formula C16H18N4O3
InChI InChI=1S/C16H18N4O3/c1-10-14(21)20(11-7-5-4-6-8-11)9-12-13(17-10)18-16(23-3)19(2)15(12)22/h4-8,10,17H,9H2,1-3H3
InChIKey CVLPYGWYGQIWSQ-UHFFFAOYSA-N
Instrument Name SHIMADZU 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2016.07.012
Molecular Weight 314.345 g/mol
Reported Formula C16H18N4O3
SMILES N1C(C(N(CC=2C(N(C(=NC12)OC)C)=O)c1ccccc1)=O)C
SPLASH splash10-001l-2901000000-63ca34c8b699c011d15a
Source of Spectrum AJC-12-SM116-8b
Wiley ID 1857397