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3-butylpenta-3,4-dien-2-one
SpectraBase Compound ID 94YmqWDQiXq
InChI InChI=1S/C9H14O/c1-4-6-7-9(5-2)8(3)10/h2,4,6-7H2,1,3H3
InChIKey QJIGYLRGFMMLTN-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cqYFPMdGYA
Name 3-butylpenta-3,4-dien-2-one
Alternate Name(s) 3-ethenylidene-2-heptanone 3-ethenylideneheptan-2-one 3-vinylideneheptan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C9H14O
InChI InChI=1S/C9H14O/c1-4-6-7-9(5-2)8(3)10/h2,4,6-7H2,1,3H3
InChIKey QJIGYLRGFMMLTN-UHFFFAOYSA-N
Molecular Weight 138.210 g/mol
SMILES CC(C(=C=C)CCCC)=O
SPLASH splash10-0006-9000000000-1c1e72f650a783fcd83e
Source of Spectrum J-64-5327-3
Wiley ID 1530672