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4-Iodo-5-methyl-4-hexen-2-one
SpectraBase Compound ID 7omrIUv98gn
InChI InChI=1S/C7H11IO/c1-5(2)7(8)4-6(3)9/h4H2,1-3H3
InChIKey CDBUQXDLVRLLSK-UHFFFAOYSA-N
Mol Weight 238.07 g/mol
Molecular Formula C7H11IO
Exact Mass 237.98546 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qm1GEqFmjE
Name 4-Iodo-5-methyl-4-hexen-2-one
Alternate Name(s) 4-iodanyl-5-methyl-hex-4-en-2-one 4-iodo-5-methyl-hex-4-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C7H11IO
InChI InChI=1S/C7H11IO/c1-5(2)7(8)4-6(3)9/h4H2,1-3H3
InChIKey CDBUQXDLVRLLSK-UHFFFAOYSA-N
Molecular Weight 238.068 g/mol
SMILES CC(CC(=C(C)C)I)=O
SPLASH splash10-0006-9020000000-4bdfc12d6e3a9526553c
Source of Spectrum J-64-5328-10
Wiley ID 1530663