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2-Ethylidene-6,6-dimethyl-1-hydroxycyclohexaneacetic acid
SpectraBase Compound ID B528AcyESJh
InChI InChI=1S/C12H20O3/c1-4-9-6-5-7-11(2,3)12(9,15)8-10(13)14/h4,15H,5-8H2,1-3H3,(H,13,14)/b9-4+
InChIKey JFWBYLRAHZTFEU-RUDMXATFSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IGIL8WUgYWk
Name 2-Ethylidene-6,6-dimethyl-1-hydroxycyclohexaneacetic acid
Alternate Name(s) [(6E)-6-ethylidene-1-hydroxy-2,2-dimethylcyclohexyl]acetic acid 2-[(6E)-6-ethylidene-1-hydroxy-2,2-dimethylcyclohexyl]acetic acid 2-[(6E)-6-ethylidene-2,2-dimethyl-1-oxidanyl-cyclohexyl]ethanoic acid
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-4-9-6-5-7-11(2,3)12(9,15)8-10(13)14/h4,15H,5-8H2,1-3H3,(H,13,14)/b9-4+
InChIKey JFWBYLRAHZTFEU-RUDMXATFSA-N
Molecular Weight 212.289 g/mol
SMILES OC(CC1(\C(=C\C)CCCC1(C)C)O)=O
SPLASH splash10-0006-9510000000-fb064b9241fda2eddbbd
Source of Spectrum SO-0-1106-5
Wiley ID 1537831