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1,4-Dipropyl-7-phenylbicyclo[2.2.2]octa-5,7-diene-2,3-dione
SpectraBase Compound ID 5cymraax0ZP
InChI InChI=1S/C20H22O2/c1-3-10-19-12-13-20(11-4-2,18(22)17(19)21)16(14-19)15-8-6-5-7-9-15/h5-9,12-14H,3-4,10-11H2,1-2H3
InChIKey JXUAUPLWCZBQRY-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MdkOWy7OJM
Name 1,4-Dipropyl-7-phenylbicyclo[2.2.2]octa-5,7-diene-2,3-dione
Alternate Name(s) 5-Phenyl-1,4-dipropylbicyclo[2.2.2]octa-5,7-diene-2,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-3-10-19-12-13-20(11-4-2,18(22)17(19)21)16(14-19)15-8-6-5-7-9-15/h5-9,12-14H,3-4,10-11H2,1-2H3
InChIKey JXUAUPLWCZBQRY-UHFFFAOYSA-N
Molecular Weight 294.394 g/mol
SMILES C12(C(=CC(C=C2)(CCC)C(C1=O)=O)c1ccccc1)CCC
SPLASH splash10-000i-0190000000-c26ed35ea2e20307576e
Source of Spectrum QA-30-75-6
Wiley ID 860861