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1,4-Butanedione, 1,4-bis(4-bromophenyl)-
SpectraBase Compound ID HVc1bgkOAKA
InChI InChI=1S/C16H12Br2O2/c17-13-5-1-11(2-6-13)15(19)9-10-16(20)12-3-7-14(18)8-4-12/h1-8H,9-10H2
InChIKey VOJRFGKKQMVGPH-UHFFFAOYSA-N
Mol Weight 396.08 g/mol
Molecular Formula C16H12Br2O2
Exact Mass 393.920406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ty9o4IEp5H
Name 1,4-Butanedione, 1,4-bis(4-bromophenyl)-
Alternate Name(s) 1,4-bis(4-bromophenyl)butane-1,4-dione 1,4-Bis(4-bromophenyl)-1,4-butanedione
CAS Registry Number 2461-83-8
Comments Less than 3 mono-isotopic peaks
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Formula C16H12Br2O2
InChI InChI=1S/C16H12Br2O2/c17-13-5-1-11(2-6-13)15(19)9-10-16(20)12-3-7-14(18)8-4-12/h1-8H,9-10H2
InChIKey VOJRFGKKQMVGPH-UHFFFAOYSA-N
Molecular Weight 396.078 g/mol
SMILES C(CCC(=O)c1ccc(cc1)Br)(=O)c1ccc(cc1)Br
SPLASH splash10-001i-0900000000-76cbf5fece93c581dea0
Source of Spectrum HE-2004-1189-1
Wiley ID 1581807