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6,7-dimethoxy-3-(4-methylphenyl)-2,4(1H,3H)-quinazolinedione

View entire compound with spectra: 2 NMR

6,7-dimethoxy-3-(4-methylphenyl)-2,4(1H,3H)-quinazolinedione
SpectraBase Compound ID 6pd5mIIMhBs
InChI InChI=1S/C17H16N2O4/c1-10-4-6-11(7-5-10)19-16(20)12-8-14(22-2)15(23-3)9-13(12)18-17(19)21/h4-9H,1-3H3,(H,18,21)
InChIKey HEOCGFLTKDYEPD-UHFFFAOYSA-N
Mol Weight 312.33 g/mol
Molecular Formula C17H16N2O4
Exact Mass 312.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQ8B8xvDa0z
Name 6,7-Dimethoxy-3-(4-methylphenyl)-2,4(1H,3H)-quinazolinedione
Comments Computed using HOSE algorithm
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Exact Mass 312.111006999 u
Formula C17H16N2O4
InChI InChI=1S/C17H16N2O4/c1-10-4-6-11(7-5-10)19-16(20)12-8-14(22-2)15(23-3)9-13(12)18-17(19)21/h4-9H,1-3H3,(H,18,21)
InChIKey HEOCGFLTKDYEPD-UHFFFAOYSA-N
Molecular Weight 312.325 g/mol
SMILES N1C=2C=C(C(=CC2C(N(C1=O)C1=CC=C(C=C1)C)=O)OC)OC