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N-[2-(2-chlorophenyl)-4-quinazolinyl]-N-(3,4-dichlorophenyl)amine

View entire compound with spectra: 2 NMR

N-[2-(2-chlorophenyl)-4-quinazolinyl]-N-(3,4-dichlorophenyl)amine
SpectraBase Compound ID BVpq3rDKWox
InChI InChI=1S/C20H12Cl3N3/c21-15-7-3-1-5-13(15)19-25-18-8-4-2-6-14(18)20(26-19)24-12-9-10-16(22)17(23)11-12/h1-11H,(H,24,25,26)
InChIKey KFAVEXJFRKWOCP-UHFFFAOYSA-N
Mol Weight 400.7 g/mol
Molecular Formula C20H12Cl3N3
Exact Mass 399.00968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uUcVm86ioe
Name N-[2-(2-Chlorophenyl)-4-quinazolinyl]-N-(3,4-dichlorophenyl)amine
Comments Computed using HOSE algorithm
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Exact Mass 399.009680498 u
Formula C20H12Cl3N3
InChI InChI=1S/C20H12Cl3N3/c21-15-7-3-1-5-13(15)19-25-18-8-4-2-6-14(18)20(26-19)24-12-9-10-16(22)17(23)11-12/h1-11H,(H,24,25,26)
InChIKey KFAVEXJFRKWOCP-UHFFFAOYSA-N
Molecular Weight 400.696 g/mol
SMILES N(C1=NC(=NC=2C1=CC=CC2)C=1C(Cl)=CC=CC1)C1=CC(Cl)=C(C=C1)Cl