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[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-cyclohexyl-2-oxo-acetate
SpectraBase Compound ID IVfxePPMwuf
InChI InChI=1S/C18H30O3/c1-12(2)15-10-9-13(3)11-16(15)21-18(20)17(19)14-7-5-4-6-8-14/h12-16H,4-11H2,1-3H3/t13-,15+,16-/m1/s1
InChIKey AXILCYZYPMCFEI-VNQPRFMTSA-N
Mol Weight 294.44 g/mol
Molecular Formula C18H30O3
Exact Mass 294.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlZOATR6jbu
Name [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-cyclohexyl-2-oxo-acetate
Appearance Colorless oil
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Formula C18H30O3
InChI InChI=1S/C18H30O3/c1-12(2)15-10-9-13(3)11-16(15)21-18(20)17(19)14-7-5-4-6-8-14/h12-16H,4-11H2,1-3H3/t13-,15+,16-/m1/s1
InChIKey AXILCYZYPMCFEI-VNQPRFMTSA-N
Ionization Type EI
Molecular Weight 294.435 g/mol
SMILES C1CCCC(C1)C(C(O[C@@]1(C[C@@](CC[C@]1(C(C)C)[H])(C)[H])[H])=O)=O
SPLASH splash10-001i-9200000000-1ce42df26d1a849ed774
Source of Spectrum CN1160306C
Wiley ID 1843819