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HERBERTENONE-A;(4S*)-2-(1,2,2-TRIMETHYLCYCLOPENTYL)-4-HYDROXY-4-METHYLCYCLOHEXA-2,5-DIENE
SpectraBase Compound ID EVqCpxe3Ggp
InChI InChI=1S/C15H22O2/c1-13(2)7-5-8-15(13,4)11-10-14(3,17)9-6-12(11)16/h6,9-10,17H,5,7-8H2,1-4H3/t14-,15+/m0/s1
InChIKey IAHVMQAYDBMMQB-LSDHHAIUSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QamO35Tpg
Name Herbertenone A
Alternate Name(s) (S)-4-hydroxy-4-methyl-2-((S)-1,2,2-trimethylcyclopentyl)cyclohexa-2,5-dien-1-one
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Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-13(2)7-5-8-15(13,4)11-10-14(3,17)9-6-12(11)16/h6,9-10,17H,5,7-8H2,1-4H3/t14-,15+/m0/s1
InChIKey IAHVMQAYDBMMQB-LSDHHAIUSA-N
Molecular Weight 234.339 g/mol
SMILES O[C@]1(C=CC(C(=C1)[C@@]1(C(CCC1)(C)C)C)=O)C
SPLASH splash10-014l-3920000000-d54182f44e4dbc3029db
Source of Spectrum Hiroshi Irita, et al. Phytochemistry, V.55, 2000, P.247-253
Wiley ID 1817324