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2-(2-bromanyl-4-methyl-phenyl)-4H-isoquinoline-1,3-dione
SpectraBase Compound ID 6rYczTGS2KP
InChI InChI=1S/C16H12BrNO2/c1-10-6-7-14(13(17)8-10)18-15(19)9-11-4-2-3-5-12(11)16(18)20/h2-8H,9H2,1H3
InChIKey BWKUYZVFAFFROW-UHFFFAOYSA-N
Mol Weight 330.18 g/mol
Molecular Formula C16H12BrNO2
Exact Mass 329.005142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXJvBgG16om
Name 2-(2-bromanyl-4-methyl-phenyl)-4H-isoquinoline-1,3-dione
Alternate Name(s) 2-(2-bromo-4-methyl-phenyl)-4H-isoquinoline-1,3-dione 2-(2-bromo-4-methyl-phenyl)-4H-isoquinoline-1,3-quinone
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Formula C16H12BrNO2
InChI InChI=1S/C16H12BrNO2/c1-10-6-7-14(13(17)8-10)18-15(19)9-11-4-2-3-5-12(11)16(18)20/h2-8H,9H2,1H3
InChIKey BWKUYZVFAFFROW-UHFFFAOYSA-N
Molecular Weight 330.181 g/mol
SMILES C1(N(C(Cc2ccccc12)=O)c1c(cc(cc1)C)Br)=O
SPLASH splash10-0udi-5190000000-2f1f6bae03ff33516c02
Source of Spectrum KC-61-4217-1
Wiley ID 1628852