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(1S,2R,6S,7R,8R)-Methyl 8-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-9-oxatricyclo[5.3.0.0(2,6)]decan-5,10-dione
SpectraBase Compound ID 87xoRHwDHYI
InChI InChI=1S/C19H28O4/c1-9(2)11-5-4-10(3)8-14(11)22-19-17-15-12(6-7-13(15)20)16(17)18(21)23-19/h9-12,14-17,19H,4-8H2,1-3H3/t10?,11?,12-,14?,15-,16+,17-,19-/m1/s1
InChIKey XCSOFTXVMHZOCB-FCDDIRGJSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ceKQ4yWUff
Name (1S,2R,6S,7R,8R)-Methyl 8-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-9-oxatricyclo[5.3.0.0(2,6)]decan-5,10-dione
Alternate Name(s) (1S,2R,6S,7R,8R)-8-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-9-oxatricyclo[5.3.0.0(2,6)]decan-5,10-dione (3R,3aR,3bS,6aR,6bS)-3-[(2-isopropyl-5-methylcyclohexyl)oxy]hexahydro-1H-cyclopenta[3,4]cyclobuta[1,2-c]furan-1,4(3H)-dione 8-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-9-oxatricyclo[5.3.0.0(2,6)]decan-5,10-dione Methyl 8-[(2'-Isopropyl-5'-methyl)cyclohexyloxy]-9-oxatricyclo[5.3.0.0(2,6)]decan-5,10-dione
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Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-9(2)11-5-4-10(3)8-14(11)22-19-17-15-12(6-7-13(15)20)16(17)18(21)23-19/h9-12,14-17,19H,4-8H2,1-3H3/t10?,11?,12-,14?,15-,16+,17-,19-/m1/s1
InChIKey XCSOFTXVMHZOCB-FCDDIRGJSA-N
Molecular Weight 320.429 g/mol
SMILES C1([C@@]2([C@]([H])([C@@](O1)(OC1C(CCC(C1)C)C(C)C)[H])[C@@]1([C@]2(CCC1=O)[H])[H])[H])=O
SPLASH splash10-000j-4900000000-c64cf3812a68ef64aa74
Source of Spectrum F-54-4881-2
Wiley ID 806694