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1-(3-Bromophenyl)-4,4-dimethylpentan-2-one
SpectraBase Compound ID 1jeJYs1tcYY
InChI InChI=1S/C13H17BrO/c1-13(2,3)9-12(15)8-10-5-4-6-11(14)7-10/h4-7H,8-9H2,1-3H3
InChIKey HATFKAFUAFLHKM-UHFFFAOYSA-N
Mol Weight 269.18 g/mol
Molecular Formula C13H17BrO
Exact Mass 268.046278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 348QCsVTUBH
Name 1-(3-Bromophenyl)-4,4-dimethylpentan-2-one
Alternate Name(s) 1-(3-bromophenyl)-4,4-dimethyl-2-pentanone
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Formula C13H17BrO
InChI InChI=1S/C13H17BrO/c1-13(2,3)9-12(15)8-10-5-4-6-11(14)7-10/h4-7H,8-9H2,1-3H3
InChIKey HATFKAFUAFLHKM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.200800161
Molecular Weight 269.182 g/mol
SMILES c1(Br)cc(ccc1)CC(CC(C)(C)C)=O
SPLASH splash10-052b-9100000000-df1b98493b8d01733b63
Source of Spectrum CAJ-3-1686-4h
Wiley ID 1775076