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Methyl 1,5-Di-tert-Butylbicyclo[2.2.2]octa-5,7-dien-2,3-dione-7-carboxylate
SpectraBase Compound ID K8nEjXyR1hS
InChI InChI=1S/C18H24O4/c1-16(2,3)12-9-18(17(4,5)6)11(15(21)22-7)8-10(12)13(19)14(18)20/h8-10H,1-7H3/t10-,18+/m0/s1
InChIKey OUTKFHSVNOHEFA-XTZNXHDOSA-N
Mol Weight 304.39 g/mol
Molecular Formula C18H24O4
Exact Mass 304.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZFfujTbyeQ
Name Methyl 1,5-Di-tert-Butylbicyclo[2.2.2]octa-5,7-dien-2,3-dione-7-carboxylate
Alternate Name(s) Methyl 1,5-ditert-butyl-7,8-dioxobicyclo[2.2.2]octa-2,5-diene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4
InChI InChI=1S/C18H24O4/c1-16(2,3)12-9-18(17(4,5)6)11(15(21)22-7)8-10(12)13(19)14(18)20/h8-10H,1-7H3/t10-,18+/m0/s1
InChIKey OUTKFHSVNOHEFA-XTZNXHDOSA-N
Molecular Weight 304.386 g/mol
SMILES [C@@]12(C(=C[C@@](C(=C2)C(C)(C)C)(C(C1=O)=O)[H])C(=O)OC)C(C)(C)C
SPLASH splash10-0159-0090000000-581a3e761985e8c8a771
Source of Spectrum QA-33-75-9
Wiley ID 861037