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2-(Phenyl)-4-(4-phenylpiperazin-1-yl)-6-iodoquinazoline
SpectraBase Compound ID K4g3hPnOk3T
InChI InChI=1S/C24H21IN4/c25-19-11-12-22-21(17-19)24(27-23(26-22)18-7-3-1-4-8-18)29-15-13-28(14-16-29)20-9-5-2-6-10-20/h1-12,17H,13-16H2
InChIKey BAYAUFOCOYCSFI-UHFFFAOYSA-N
Mol Weight 492.36 g/mol
Molecular Formula C24H21IN4
Exact Mass 492.081092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gl8IS1IsEcg
Name 2-(Phenyl)-4-(4-phenylpiperazin-1-yl)-6-iodoquinazoline
Comments Less than 3 mono-isotopic peaks
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Formula C24H21IN4
InChI InChI=1S/C24H21IN4/c25-19-11-12-22-21(17-19)24(27-23(26-22)18-7-3-1-4-8-18)29-15-13-28(14-16-29)20-9-5-2-6-10-20/h1-12,17H,13-16H2
InChIKey BAYAUFOCOYCSFI-UHFFFAOYSA-N
Molecular Weight 492.364 g/mol
SMILES c1(nc(-c2ccccc2)nc2c1cc(cc2)I)N1CCN(CC1)c1ccccc1
SPLASH splash10-0006-0000900000-9823e349c2162f050d08
Source of Spectrum F2-45-4951-7f
Synonyms 6-iodo-2-phenyl-4-(4-phenyl-1-piperazinyl)quinazoline 6-iodo-2-phenyl-4-(4-phenylpiperazin-1-yl)quinazoline 6-iodanyl-2-phenyl-4-(4-phenylpiperazin-1-yl)quinazoline
Wiley ID 1703667