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(1R*,2R*,3S*)-2-Acetoxy-3-butylylcyclohexanol
SpectraBase Compound ID 16QX0UDSQC1
InChI InChI=1S/C12H22O3/c1-3-4-6-10-7-5-8-11(14)12(10)15-9(2)13/h10-12,14H,3-8H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey QYUWYKKAOJVFGJ-QJPTWQEYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oXaGuTJHI
Name (1R*,2R*,3S*)-2-Acetoxy-3-butylylcyclohexanol
Alternate Name(s) Acetic acid[(1R,2S,6R)-2-butyl-6-hydroxy-cyclohexyl]ester [(1R,2S,6R)-2-butyl-6-hydroxy-cyclohexyl]acetate [(1R,2S,6R)-2-butyl-6-oxidanyl-cyclohexyl]ethanoate Acetic acid [(1R,2S,6R)-2-butyl-6-hydroxycyclohexyl] ester [(1R,2S,6R)-2-butyl-6-hydroxycyclohexyl] acetate [(1R,2S,6R)-2-butyl-6-hydroxy-cyclohexyl] acetate [(1R,2S,6R)-2-butyl-6-oxidanyl-cyclohexyl] ethanoate
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Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-3-4-6-10-7-5-8-11(14)12(10)15-9(2)13/h10-12,14H,3-8H2,1-2H3/t10-,11+,12+/m0/s1
InChIKey QYUWYKKAOJVFGJ-QJPTWQEYSA-N
Molecular Weight 214.305 g/mol
SMILES O[C@]1([C@](OC(=O)C)([C@](CCC1)(CCCC)[H])[H])[H]
SPLASH splash10-0005-9100000000-2fbf843fbb0bcf876fa0
Source of Spectrum J-57-5034-8
Wiley ID 1213648