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2-BROMO-3-METHYL-5-METHOXY-[1.4]-NAPHTHOQUINONE
SpectraBase Compound ID GKTca8xNEM6
InChI InChI=1S/C12H9BrO3/c1-6-10(13)12(15)7-4-3-5-8(16-2)9(7)11(6)14/h3-5H,1-2H3
InChIKey RUDOIMASNZKOGK-UHFFFAOYSA-N
Mol Weight 281.11 g/mol
Molecular Formula C12H9BrO3
Exact Mass 279.973507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CAGPnieLZy
Name 2-bromanyl-5-methoxy-3-methyl-naphthalene-1,4-dione
Comments Less than 3 mono-isotopic peaks
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Formula C12H9BrO3
InChI InChI=1S/C12H9BrO3/c1-6-10(13)12(15)7-4-3-5-8(16-2)9(7)11(6)14/h3-5H,1-2H3
InChIKey RUDOIMASNZKOGK-UHFFFAOYSA-N
Molecular Weight 281.105 g/mol
SMILES C=1(C(c2c(OC)cccc2C(C1Br)=O)=O)C
SPLASH splash10-001i-0090000000-ab2931b5fcc6f709245d
Source of Spectrum J-62-2353-3
Synonyms 2-bromo-5-methoxy-3-methyl-1,4-naphthoquinone 2-bromo-5-methoxy-3-methyl-naphthalene-1,4-dione
Wiley ID 1283431