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2-Amino-5-keto-7,7-dimethyl-4-(o-tolyl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile
SpectraBase Compound ID KE0gS25qulR
InChI InChI=1S/C19H21N3O/c1-11-6-4-5-7-12(11)16-13(10-20)18(21)22-14-8-19(2,3)9-15(23)17(14)16/h4-7,16,22H,8-9,21H2,1-3H3
InChIKey YCZPBORTHAPWAX-UHFFFAOYSA-N
Mol Weight 307.4 g/mol
Molecular Formula C19H21N3O
Exact Mass 307.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2o3hclwimCK
Name 2-Amino-5-keto-7,7-dimethyl-4-(o-tolyl)-1,4,6,8-tetrahydroquinoline-3-carbonitrile
Comments Computed using HOSE algorithm
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Exact Mass 307.168462307 u
Formula C19H21N3O
InChI InChI=1S/C19H21N3O/c1-11-6-4-5-7-12(11)16-13(10-20)18(21)22-14-8-19(2,3)9-15(23)17(14)16/h4-7,16,22H,8-9,21H2,1-3H3
InChIKey YCZPBORTHAPWAX-UHFFFAOYSA-N
Molecular Weight 307.397 g/mol
SMILES C=1(C(C=2C(CC(CC2NC1N)(C)C)=O)C=1C(C)=CC=CC1)C#N