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4-(2-Phenyl-6,8-dibromo-4-oxo-(4H)quinazolin-3-yl)-N-(1,3-dioxoisoindolin-2-yl)benzamide
SpectraBase Compound ID 3PTVKfvmfdI
InChI InChI=1S/C29H16Br2N4O4/c30-18-14-22-24(23(31)15-18)32-25(16-6-2-1-3-7-16)34(27(22)37)19-12-10-17(11-13-19)26(36)33-35-28(38)20-8-4-5-9-21(20)29(35)39/h1-15H,(H,33,36)
InChIKey HXZFYDLIGNNHLQ-UHFFFAOYSA-N
Mol Weight 644.28 g/mol
Molecular Formula C29H16Br2N4O4
Exact Mass 641.953831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5uvqknAnUz
Name 4-(2-Phenyl-6,8-dibromo-4-oxo-(4H)quinazolin-3-yl)-N-(1,3-dioxoisoindolin-2-yl)benzamide
Alternate Name(s) 4-(6,8-dibromo-4-oxo-2-phenyl-3-quinazolinyl)-N-(1,3-dioxo-2-isoindolyl)benzamide 4-(6,8-dibromo-4-oxo-2-phenylquinazolin-3-yl)-N-(1,3-dioxoisoindol-2-yl)benzamide 4-(6,8-dibromo-4-oxo-2-phenyl-quinazolin-3-yl)-N-(1,3-dioxoisoindolin-2-yl)benzamide 4-[6,8-bis(bromanyl)-4-oxidanylidene-2-phenyl-quinazolin-3-yl]-N-[1,3-bis(oxidanylidene)isoindol-2-yl]benzamide
Comments Less than 3 mono-isotopic peaks
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Formula C29H16Br2N4O4
InChI InChI=1S/C29H16Br2N4O4/c30-18-14-22-24(23(31)15-18)32-25(16-6-2-1-3-7-16)34(27(22)37)19-12-10-17(11-13-19)26(36)33-35-28(38)20-8-4-5-9-21(20)29(35)39/h1-15H,(H,33,36)
InChIKey HXZFYDLIGNNHLQ-UHFFFAOYSA-N
Molecular Weight 644.279 g/mol
SMILES N(N1C(c2ccccc2C1=O)=O)C(c1ccc(N2C(c3cc(Br)cc(c3N=C2c2ccccc2)Br)=O)cc1)=O
SPLASH splash10-0002-0009000000-e9009003ab901d6938e1
Source of Spectrum F2-45-3319-14
Wiley ID 1689296