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2-(Phenyl)-4-(4-phenylpiperidino)-6-bromoquinazoline
SpectraBase Compound ID h5PzRHUt9M
InChI InChI=1S/C25H22BrN3/c26-21-11-12-23-22(17-21)25(28-24(27-23)20-9-5-2-6-10-20)29-15-13-19(14-16-29)18-7-3-1-4-8-18/h1-12,17,19H,13-16H2
InChIKey XWWDCSSQXNHZRE-UHFFFAOYSA-N
Mol Weight 444.38 g/mol
Molecular Formula C25H22BrN3
Exact Mass 443.099711 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8iD2xn2E9O9
Name 2-(Phenyl)-4-(4-phenylpiperidino)-6-bromoquinazoline
Alternate Name(s) 6-bromo-2-phenyl-4-(4-phenyl-1-piperidinyl)quinazoline 6-bromo-2-phenyl-4-(4-phenylpiperidin-1-yl)quinazoline 6-bromo-2-phenyl-4-(4-phenyl-1-piperidyl)quinazoline 6-bromanyl-2-phenyl-4-(4-phenylpiperidin-1-yl)quinazoline
Comments Less than 3 mono-isotopic peaks
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Formula C25H22BrN3
InChI InChI=1S/C25H22BrN3/c26-21-11-12-23-22(17-21)25(28-24(27-23)20-9-5-2-6-10-20)29-15-13-19(14-16-29)18-7-3-1-4-8-18/h1-12,17,19H,13-16H2
InChIKey XWWDCSSQXNHZRE-UHFFFAOYSA-N
Molecular Weight 444.376 g/mol
SMILES c1(nc(-c2ccccc2)nc2c1cc(cc2)Br)N1CCC(CC1)c1ccccc1
SPLASH splash10-0007-0000900000-3a49592c96281f916004
Source of Spectrum F2-45-4950-6d
Wiley ID 1703678