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2,3-Dehydro-4-oxo-.beta.-ionol
SpectraBase Compound ID G3nJVITvl8t
InChI InChI=1S/C13H18O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-9,14H,1-4H3/b6-5+
InChIKey FZJGHQBGWXPTDS-AATRIKPKSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 902DiGjwwMT
Name 2,3-Dehydro-4-oxo-.beta.-ionol
Alternate Name(s) 2,4,4-trimethyl-3-[(E)-3-oxidanylbut-1-enyl]cyclohexa-2,5-dien-1-one 3-[(1E)-3-Hydroxy-1-butenyl]-2,4,4-trimethyl-2,5-cyclohexadien-1-one 3-[(E)-3-hydroxybut-1-enyl]-2,4,4-trimethyl-1-cyclohexa-2,5-dienone 3-[(E)-3-hydroxybut-1-enyl]-2,4,4-trimethyl-cyclohexa-2,5-dien-1-one
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-9,14H,1-4H3/b6-5+
InChIKey FZJGHQBGWXPTDS-AATRIKPKSA-N
Molecular Weight 206.285 g/mol
SMILES OC(\C=C\C1=C(C(=O)C=CC1(C)C)C)C
SPLASH splash10-01ox-9800000000-e05152e31c8ca7197446
Source of Spectrum PR-193-0-0
Wiley ID 1204789