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4-Bromo-5-methyl-4-hexen-2-one
SpectraBase Compound ID 5RGZh8shCC2
InChI InChI=1S/C7H11BrO/c1-5(2)7(8)4-6(3)9/h4H2,1-3H3
InChIKey PIVIIUWWBVSZSV-UHFFFAOYSA-N
Mol Weight 191.07 g/mol
Molecular Formula C7H11BrO
Exact Mass 189.999328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7P3Av0GM6H7
Name 4-Bromo-5-methyl-4-hexen-2-one
Alternate Name(s) 4-bromanyl-5-methyl-hex-4-en-2-one 4-bromo-5-methyl-hex-4-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C7H11BrO
InChI InChI=1S/C7H11BrO/c1-5(2)7(8)4-6(3)9/h4H2,1-3H3
InChIKey PIVIIUWWBVSZSV-UHFFFAOYSA-N
Molecular Weight 191.068 g/mol
SMILES CC(CC(=C(C)C)Br)=O
SPLASH splash10-0006-9000000000-417c11539ef23f5c266c
Source of Spectrum J-64-5328-10
Wiley ID 1530662