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3-(4-Bromophenyl)butan-2-one
SpectraBase Compound ID AeX8kRnIFt0
InChI InChI=1S/C10H11BrO/c1-7(8(2)12)9-3-5-10(11)6-4-9/h3-7H,1-2H3
InChIKey LJVNHGDHWDQBTR-UHFFFAOYSA-N
Mol Weight 227.1 g/mol
Molecular Formula C10H11BrO
Exact Mass 225.999328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UrQsTrdRgf
Name 3-(4-Bromophenyl)butan-2-one
Alternate Name(s) 3-(4-bromophenyl)-2-butanone
Comments Less than 3 mono-isotopic peaks
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Formula C10H11BrO
InChI InChI=1S/C10H11BrO/c1-7(8(2)12)9-3-5-10(11)6-4-9/h3-7H,1-2H3
InChIKey LJVNHGDHWDQBTR-UHFFFAOYSA-N
Molecular Weight 227.101 g/mol
SMILES CC(C(C)c1ccc(cc1)Br)=O
SPLASH splash10-001i-0940000000-15fad498db0eecb33812
Source of Spectrum F4-0-3451-4
Wiley ID 1620808