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7,7-Dimethyl-1-phenyl-4-(3-pyridinyl)-3,4,6,8-tetrahydroquinoline-2,5-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

7,7-Dimethyl-1-phenyl-4-(3-pyridinyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
SpectraBase Compound ID BHGr7FhCIlP
InChI InChI=1S/C22H22N2O2/c1-22(2)12-18-21(19(25)13-22)17(15-7-6-10-23-14-15)11-20(26)24(18)16-8-4-3-5-9-16/h3-10,14,17H,11-13H2,1-2H3
InChIKey IUSJMBYQMNDUPV-UHFFFAOYSA-N
Mol Weight 346.43 g/mol
Molecular Formula C22H22N2O2
Exact Mass 346.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KBJGgL2fRCm
Name 7,7-Dimethyl-1-phenyl-4-(3-pyridinyl)-3,4,6,8-tetrahydroquinoline-2,5-dione
Comments Computed using HOSE algorithm
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Exact Mass 346.168127954 u
Formula C22H22N2O2
InChI InChI=1S/C22H22N2O2/c1-22(2)12-18-21(19(25)13-22)17(15-7-6-10-23-14-15)11-20(26)24(18)16-8-4-3-5-9-16/h3-10,14,17H,11-13H2,1-2H3
InChIKey IUSJMBYQMNDUPV-UHFFFAOYSA-N
Molecular Weight 346.430 g/mol
SMILES C1C(CC=2N(C3=CC=CC=C3)C(=O)CC(C2C1=O)C1=CN=CC=C1)(C)C