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(3.alpha.,4a.alpha.)-3-Acetoxy-3,4,4a,5,6,7-hexahydro-9,10,11-trimethoxy-2H-dibenzo[a,c]cyclohepten-2-one
SpectraBase Compound ID 9DE5h4tydPv
InChI InChI=1S/C20H24O6/c1-11(21)26-16-8-12-6-5-7-13-9-17(23-2)19(24-3)20(25-4)18(13)14(12)10-15(16)22/h9-10,12,16H,5-8H2,1-4H3/t12-,16-/m0/s1
InChIKey BZPPNFZRWJDUQR-LRDDRELGSA-N
Mol Weight 360.41 g/mol
Molecular Formula C20H24O6
Exact Mass 360.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sWmWiF6yO
Name (3.alpha.,4a.alpha.)-3-Acetoxy-3,4,4a,5,6,7-hexahydro-9,10,11-trimethoxy-2H-dibenzo[a,c]cyclohepten-2-one
Alternate Name(s) (3.beta.,4a.beta.)-3-Acetoxy-3,4,4a,5,6,7-hexahydro-9,10,11-trimethoxy-2H-dibenzo[a,c]cyclohepten-2-one (3S,4aS)-9,10,11-trimethoxy-2-oxo-3,4,4a,5,6,7-hexahydro-2H-dibenzo[a,c]cyclohepten-3-yl acetate
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Formula C20H24O6
InChI InChI=1S/C20H24O6/c1-11(21)26-16-8-12-6-5-7-13-9-17(23-2)19(24-3)20(25-4)18(13)14(12)10-15(16)22/h9-10,12,16H,5-8H2,1-4H3/t12-,16-/m0/s1
InChIKey BZPPNFZRWJDUQR-LRDDRELGSA-N
Molecular Weight 360.406 g/mol
SMILES C1=2c3c(c(OC)c(cc3CCC[C@]1(C[C@](OC(=O)C)(C(C2)=O)[H])[H])OC)OC
SPLASH splash10-08fu-0095000000-22dc43d438e9efd31ef0
Source of Spectrum KB-1992-1422-19
Wiley ID 775683