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3-Methyl-4-oxo-5-[5'-oxo-2',6',6'-trimethylcyclohex-1'-enyl]pent-2-enal
SpectraBase Compound ID LvLsYgNckPI
InChI InChI=1S/C15H20O3/c1-10-5-6-14(18)15(3,4)12(10)9-13(17)11(2)7-8-16/h7-8H,5-6,9H2,1-4H3/b11-7+
InChIKey BYPURTIXACZBLH-YRNVUSSQSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdbBOlMPaUC
Name 3-Methyl-4-oxo-5-[5'-oxo-2',6',6'-trimethylcyclohex-1'-enyl]pent-2-enal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-10-5-6-14(18)15(3,4)12(10)9-13(17)11(2)7-8-16/h7-8H,5-6,9H2,1-4H3/b11-7+
InChIKey BYPURTIXACZBLH-YRNVUSSQSA-N
Molecular Weight 248.322 g/mol
SMILES C=1(C(C(=O)CCC1C)(C)C)CC(\C(=C\C=O)C)=O
SPLASH splash10-0002-9320000000-b60192fa9532fe9fbabe
Source of Spectrum AC-1993-366-22
Synonyms (2E)-3-methyl-4-oxo-5-(2,6,6-trimethyl-5-oxo-1-cyclohexen-1-yl)-2-pentenal
Wiley ID 811504