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3,7-Undecadiene-2,5,10-trione, 6,6-dimethyl-, (E,E)-
SpectraBase Compound ID LchoFDkDv8G
InChI InChI=1S/C13H18O3/c1-10(14)6-5-9-13(3,4)12(16)8-7-11(2)15/h5,7-9H,6H2,1-4H3/b8-7+,9-5+
InChIKey HDKCAQGCXKTBCU-DMQCZMPNSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsKeY0tgUTs
Name 3,7-Undecadiene-2,5,10-trione, 6,6-dimethyl-, (E,E)-
CAS Registry Number 80114-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-10(14)6-5-9-13(3,4)12(16)8-7-11(2)15/h5,7-9H,6H2,1-4H3/b8-7+,9-5+
InChIKey HDKCAQGCXKTBCU-DMQCZMPNSA-N
Molecular Weight 222.284 g/mol
SMILES C(\C=C\C(=O)C)(C(\C=C\CC(=O)C)(C)C)=O
SPLASH splash10-002g-9300000000-50a09a947632eaae8f65
Source of Spectrum H-64-1775-0
Synonyms (3E,7E)-6,6-dimethyl-3,7-undecadien-2,5,10-trione (3E,7E)-6,6-dimethyl-3,7-undecadiene-2,5,10-trione
Wiley ID 1222491