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Dimenthyl 8,8-dimethyl-2-oxobicyclo[2.2.2]oct-5-ene-5,6-dicarboxylate
SpectraBase Compound ID FXHqY8uu40c
InChI InChI=1S/C32H50O5/c1-17(2)21-11-9-19(5)13-26(21)36-30(34)28-23-16-32(7,8)24(15-25(23)33)29(28)31(35)37-27-14-20(6)10-12-22(27)18(3)4/h17-24,26-27H,9-16H2,1-8H3/t19?,20?,21?,22?,23-,24+,26?,27?/m1/s1
InChIKey IHDOPLBBWGXJTC-GKSLZPCSSA-N
Mol Weight 514.7 g/mol
Molecular Formula C32H50O5
Exact Mass 514.365825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lmx7y0ucAGM
Name Dimenthyl 8,8-dimethyl-2-oxobicyclo[2.2.2]oct-5-ene-5,6-dicarboxylate
Alternate Name(s) bis(2-isopropyl-5-methylcyclohexyl) 5,5-dimethyl-7-oxobicyclo[2.2.2]oct-2-ene-2,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H50O5
InChI InChI=1S/C32H50O5/c1-17(2)21-11-9-19(5)13-26(21)36-30(34)28-23-16-32(7,8)24(15-25(23)33)29(28)31(35)37-27-14-20(6)10-12-22(27)18(3)4/h17-24,26-27H,9-16H2,1-8H3/t19?,20?,21?,22?,23-,24+,26?,27?/m1/s1
InChIKey IHDOPLBBWGXJTC-GKSLZPCSSA-N
Molecular Weight 514.747 g/mol
SMILES C1(=C([C@]2(C(C[C@@]1(C(C2)(C)C)[H])=O)[H])C(OC1C(CCC(C1)C)C(C)C)=O)C(OC1C(CCC(C1)C)C(C)C)=O
SPLASH splash10-000i-9180000000-9fd7418b5e0766309d6b
Source of Spectrum F-55-14837-21
Wiley ID 840282