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8-[4-Acetamino-1-methylbutylamino]-6-methoxyquinoline
SpectraBase Compound ID IkP0CtcV4AC
InChI InChI=1S/C17H23N3O2/c1-12(6-4-8-18-13(2)21)20-16-11-15(22-3)10-14-7-5-9-19-17(14)16/h5,7,9-12,20H,4,6,8H2,1-3H3,(H,18,21)
InChIKey YVURERLGLAYCCQ-UHFFFAOYSA-N
Mol Weight 301.39 g/mol
Molecular Formula C17H23N3O2
Exact Mass 301.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vVbDo1IaRh
Name 8-[4-Acetamino-1-methylbutylamino]-6-methoxyquinoline
Comments Computed using HOSE algorithm
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Exact Mass 301.179026991 u
Formula C17H23N3O2
InChI InChI=1S/C17H23N3O2/c1-12(6-4-8-18-13(2)21)20-16-11-15(22-3)10-14-7-5-9-19-17(14)16/h5,7,9-12,20H,4,6,8H2,1-3H3,(H,18,21)
InChIKey YVURERLGLAYCCQ-UHFFFAOYSA-N
Molecular Weight 301.390 g/mol
SMILES C1=2C(=CC(=CC2NC(C)CCCNC(=O)C)OC)C=CC=N1