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9-Hydroxymegastigm-7-en-9-one
SpectraBase Compound ID FuagliDiGtl
InChI InChI=1S/C13H22O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-6,9,11-12,15H,7-8H2,1-4H3/b6-5+/t9-,11-,12+/m1/s1
InChIKey FEQPLOLFLKUQNO-SLAVXOHESA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FXqQmD3js
Name 9-Hydroxymegastigm-7-en-9-one
Alternate Name(s) (3E)-4-(4-hydroxy-2,2,6-trimethylcyclohexyl)-3-buten-2-one (E)-4-((1R,4R,6R)-4-Hydroxy-2,2,6-trimethyl-cyclohexyl)-but-3-en-2-one 3-Hydroxy-5,6-dihydro-.beta.-ionone (E)-4-[(1R,4R,6R)-4-hydroxy-2,2,6-trimethylcyclohexyl]-3-buten-2-one (E)-4-[(1R,4R,6R)-4-hydroxy-2,2,6-trimethylcyclohexyl]but-3-en-2-one (E)-4-[(1R,4R,6R)-2,2,6-trimethyl-4-oxidanyl-cyclohexyl]but-3-en-2-one
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Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-6,9,11-12,15H,7-8H2,1-4H3/b6-5+/t9-,11-,12+/m1/s1
InChIKey FEQPLOLFLKUQNO-SLAVXOHESA-N
Molecular Weight 210.317 g/mol
SMILES O[C@@]1(C[C@]([C@](\C=C\C(=O)C)(C(C1)(C)C)[H])(C)[H])[H]
SPLASH splash10-01ot-9600000000-97ee73ae83496d3474fe
Source of Spectrum U-1994-1045-8
Wiley ID 766133