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1,4-Naphthalenedione, 6,7-dibromo-2,3-dimethyl-
SpectraBase Compound ID ByJEok1PPzm
InChI InChI=1S/C12H8Br2O2/c1-5-6(2)12(16)8-4-10(14)9(13)3-7(8)11(5)15/h3-4H,1-2H3
InChIKey TWIQUIZSKXUQFN-UHFFFAOYSA-N
Mol Weight 344.0 g/mol
Molecular Formula C12H8Br2O2
Exact Mass 341.889105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILVzDfmBgZc
Name 1,4-Naphthalenedione, 6,7-dibromo-2,3-dimethyl-
CAS Registry Number 117157-43-4
Comments Less than 3 mono-isotopic peaks
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Formula C12H8Br2O2
InChI InChI=1S/C12H8Br2O2/c1-5-6(2)12(16)8-4-10(14)9(13)3-7(8)11(5)15/h3-4H,1-2H3
InChIKey TWIQUIZSKXUQFN-UHFFFAOYSA-N
Molecular Weight 344.002 g/mol
SMILES c12c(C(=O)C(=C(C2=O)C)C)cc(c(c1)Br)Br
SPLASH splash10-0006-0009000000-e08320cb04ce92fde73b
Source of Spectrum KC-1988-561-0
Synonyms 6,7-Dibromo-2,3-dimethyl-1,4-naphthoquinone 6,7-dibromo-2,3-dimethylnaphthoquinone
Wiley ID 1336191