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2-(3-Bromo-benzyl)-2H-phthalazin-1-one
SpectraBase Compound ID DoC41lfh1D1
InChI InChI=1S/C15H11BrN2O/c16-13-6-3-4-11(8-13)10-18-15(19)14-7-2-1-5-12(14)9-17-18/h1-9H,10H2
InChIKey CTAAEVAOZYPZLL-UHFFFAOYSA-N
Mol Weight 315.17 g/mol
Molecular Formula C15H11BrN2O
Exact Mass 314.005476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnLGQs3Gow0
Name 2-(3-Bromo-benzyl)-2H-phthalazin-1-one
Alternate Name(s) 2-(3-Bromobenzyl)-1(2H)-phthalazinone 2-(3-bromobenzyl)phthalazin-1-one 2-[(3-bromophenyl)methyl]-1-phthalazinone 2-[(3-bromophenyl)methyl]phthalazin-1-one
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Formula C15H11BrN2O
InChI InChI=1S/C15H11BrN2O/c16-13-6-3-4-11(8-13)10-18-15(19)14-7-2-1-5-12(14)9-17-18/h1-9H,10H2
InChIKey CTAAEVAOZYPZLL-UHFFFAOYSA-N
Molecular Weight 315.170 g/mol
SMILES c1cc2C=NN(C(c2cc1)=O)Cc1cc(Br)ccc1
SPLASH splash10-001i-7900000000-b54d194206fada74e6d1
Wiley ID 1465650