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N-(2,4-dichlorophenyl)-2-(4-propoxyphenyl)-4-quinazolinamine
SpectraBase Compound ID JIA13YFmji5
InChI InChI=1S/C23H19Cl2N3O/c1-2-13-29-17-10-7-15(8-11-17)22-26-20-6-4-3-5-18(20)23(28-22)27-21-12-9-16(24)14-19(21)25/h3-12,14H,2,13H2,1H3,(H,26,27,28)
InChIKey PKWQUTQPDLGMGA-UHFFFAOYSA-N
Mol Weight 424.33 g/mol
Molecular Formula C23H19Cl2N3O
Exact Mass 423.090518 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8gnbiaioUfk
Name N-(2,4-Dichlorophenyl)-2-(4-propoxyphenyl)-4-quinazolinamine
Comments Computed using HOSE algorithm
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Exact Mass 423.090517643 u
Formula C23H19Cl2N3O
InChI InChI=1S/C23H19Cl2N3O/c1-2-13-29-17-10-7-15(8-11-17)22-26-20-6-4-3-5-18(20)23(28-22)27-21-12-9-16(24)14-19(21)25/h3-12,14H,2,13H2,1H3,(H,26,27,28)
InChIKey PKWQUTQPDLGMGA-UHFFFAOYSA-N
Molecular Weight 424.331 g/mol
SMILES N(C1=NC(C=2C=CC(=CC2)OCCC)=NC2=C1C=CC=C2)C1=C(C=C(C=C1)Cl)Cl