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N-benzyl-2-(3,4-dichlorophenyl)-4-quinazolinamine
SpectraBase Compound ID 4eeVPrjU8FM
InChI InChI=1S/C21H15Cl2N3/c22-17-11-10-15(12-18(17)23)20-25-19-9-5-4-8-16(19)21(26-20)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,24,25,26)
InChIKey PRXGRDLUKBQUKB-UHFFFAOYSA-N
Mol Weight 380.28 g/mol
Molecular Formula C21H15Cl2N3
Exact Mass 379.064303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANsk3j1f8DG
Name N-Benzyl-2-(3,4-dichlorophenyl)-4-quinazolinamine
Comments Computed using HOSE algorithm
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Exact Mass 379.064302895 u
Formula C21H15Cl2N3
InChI InChI=1S/C21H15Cl2N3/c22-17-11-10-15(12-18(17)23)20-25-19-9-5-4-8-16(19)21(26-20)24-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,24,25,26)
InChIKey PRXGRDLUKBQUKB-UHFFFAOYSA-N
Molecular Weight 380.278 g/mol
SMILES N(C1=NC(=NC=2C1=CC=CC2)C=1C=C(Cl)C(=CC1)Cl)CC1=CC=CC=C1