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Phomotenone
SpectraBase Compound ID Fd0AVh5SAcK
InChI InChI=1S/C11H18O2/c1-4-5-9(12)11-7(2)6-10(13)8(11)3/h7,9,12H,4-6H2,1-3H3/t7-,9+/m1/s1
InChIKey NMGKVGASSWZGPX-APPZFPTMSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OoIpSjzKDa
Name Phomotenone
Alternate Name(s) (4R)-3-[(1S)-1-hydroxybutyl]-2,4-dimethyl-1-cyclopent-2-enone (4R)-3-[(1S)-1-hydroxybutyl]-2,4-dimethylcyclopent-2-en-1-one (4R)-2,4-dimethyl-3-[(1S)-1-oxidanylbutyl]cyclopent-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-4-5-9(12)11-7(2)6-10(13)8(11)3/h7,9,12H,4-6H2,1-3H3/t7-,9+/m1/s1
InChIKey NMGKVGASSWZGPX-APPZFPTMSA-N
Molecular Weight 182.263 g/mol
SMILES O[C@](C1=C(C(=O)C[C@]1(C)[H])C)(CCC)[H]
SPLASH splash10-001i-0900000000-40fce09d43344aa1e10b
Source of Spectrum U1-2011-2872-3
Wiley ID 1665395