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2,2'-(Isopropylmethylene)-bis[1'-hydroxy]cyclohexyl-1-en-3-one
SpectraBase Compound ID H2Yh5laXsDK
InChI InChI=1S/C16H22O4/c1-9(2)14(15-10(17)5-3-6-11(15)18)16-12(19)7-4-8-13(16)20/h9,14,17,19H,3-8H2,1-2H3
InChIKey RPIOJEOMETYTRP-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Q01kWulLPy
Name 2,2'-(Isopropylmethylene)-bis[1'-hydroxy]cyclohexyl-1-en-3-one
Alternate Name(s) 3-Hydroxy-2-[1-(2-hydroxy-6-oxo-1-cyclohexen-1-yl)-2-methylpropyl]-2-cyclohexen-1-one 3-Hydroxy-2-[1-(2-hydroxy-6-oxo-1-cyclohexenyl)-2-methylpropyl]-1-cyclohex-2-enone 3-Hydroxy-2-[1-(2-hydroxy-6-oxocyclohexen-1-yl)-2-methylpropyl]cyclohex-2-en-1-one 3-Hydroxy-2-[1-(2-hydroxy-6-oxo-cyclohexen-1-yl)-2-methyl-propyl]cyclohex-2-en-1-one 2-[2-methyl-1-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)propyl]-3-oxidanyl-cyclohex-2-en-1-one
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Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-9(2)14(15-10(17)5-3-6-11(15)18)16-12(19)7-4-8-13(16)20/h9,14,17,19H,3-8H2,1-2H3
InChIKey RPIOJEOMETYTRP-UHFFFAOYSA-N
Molecular Weight 278.348 g/mol
SMILES OC1=C(C(C2=C(CCCC2=O)O)C(C)C)C(CCC1)=O
SPLASH splash10-000i-0290000000-4cdf630d0714ed19178a
Source of Spectrum K1-2000-546-17
Wiley ID 749616