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(1S,2S,7S,8S,9R)-Methyl 9-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-2,4,4-trimethyl-10-oxatricyclo[6.3.0.0(2,7)]undecan-6,11-dione
SpectraBase Compound ID G1f0tdLqYc7
InChI InChI=1S/C23H36O4/c1-12(2)14-8-7-13(3)9-16(14)26-21-17-18-15(24)10-22(4,5)11-23(18,6)19(17)20(25)27-21/h12-14,16-19,21H,7-11H2,1-6H3/t13?,14?,16?,17-,18-,19+,21+,23-/m0/s1
InChIKey CICVNGCKJHMNRB-NPLDFPJPSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rqk5zs85qP
Name (1S,2S,7S,8S,9R)-Methyl 9-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-2,4,4-trimethyl-10-oxatricyclo[6.3.0.0(2,7)]undecan-6,11-dione
Alternate Name(s) (1S,2S,7S,8S,9R)-9-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-2,4,4-trimethyl-10-oxatricyclo[6.3.0.0(2,7)]undecan-6,11-dione (3R,3aS,3bS,7aS,7bS)-3-[(2-isopropyl-5-methylcyclohexyl)oxy]-6,6,7a-trimethylhexahydrobenzo[3,4]cyclobuta[1,2-c]furan-1,4(3H,3bH)-dione 9-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-2,4,4-trimethyl-10-oxatricyclo[6.3.0.0(2,7)]undecan-6,11-dione Methyl 9-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-2,4,4-trimethyl-10-oxatricyclo[6.3.0.0(2,7)]undecan-6,11-dione
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Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-12(2)14-8-7-13(3)9-16(14)26-21-17-18-15(24)10-22(4,5)11-23(18,6)19(17)20(25)27-21/h12-14,16-19,21H,7-11H2,1-6H3/t13?,14?,16?,17-,18-,19+,21+,23-/m0/s1
InChIKey CICVNGCKJHMNRB-NPLDFPJPSA-N
Molecular Weight 376.537 g/mol
SMILES [C@@]12([C@]3(C(O[C@]([C@]3([C@@]2(C(=O)CC(C1)(C)C)[H])[H])(OC1C(CCC(C1)C)C(C)C)[H])=O)[H])C
SPLASH splash10-053i-3920000000-04092a184c6c9fdbabd5
Source of Spectrum F-54-4883-2
Wiley ID 806690