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6-Methoxy-8-[4-phthalimido-1-methylbutylamino]-4-[m-trifluoromethylstyryl]quinoline

View entire compound with spectra: 1 NMR

6-Methoxy-8-[4-phthalimido-1-methylbutylamino]-4-[m-trifluoromethylstyryl]quinoline
SpectraBase Compound ID LcJcXdkNUPg
InChI InChI=1S/C32H28F3N3O3/c1-20(7-6-16-38-30(39)25-10-3-4-11-26(25)31(38)40)37-28-19-24(41-2)18-27-22(14-15-36-29(27)28)13-12-21-8-5-9-23(17-21)32(33,34)35/h3-5,8-15,17-20,37H,6-7,16H2,1-2H3/b13-12+
InChIKey HMZHKYCKQRKDDU-OUKQBFOZSA-N
Mol Weight 559.6 g/mol
Molecular Formula C32H28F3N3O3
Exact Mass 559.208276 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dn81uz8jwUm
Name 6-Methoxy-8-[4-phthalimido-1-methylbutylamino]-4-[m-trifluoromethylstyryl]quinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 559.208276260 u
Formula C32H28F3N3O3
InChI InChI=1S/C32H28F3N3O3/c1-20(7-6-16-38-30(39)25-10-3-4-11-26(25)31(38)40)37-28-19-24(41-2)18-27-22(14-15-36-29(27)28)13-12-21-8-5-9-23(17-21)32(33,34)35/h3-5,8-15,17-20,37H,6-7,16H2,1-2H3/b13-12+
InChIKey HMZHKYCKQRKDDU-OUKQBFOZSA-N
Molecular Weight 559.589 g/mol
SMILES C(NC1=C2C(C(\C=C\C=3C=CC=C(C3)C(F)(F)F)=CC=N2)=CC(=C1)OC)(CCCN1C(C2=CC=CC=C2C1=O)=O)C