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2,4-Hexanedione, 3,5-dimethyl-1-phenyl-
SpectraBase Compound ID JotKMiqdFbt
InChI InChI=1S/C14H18O2/c1-10(2)14(16)11(3)13(15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey RSAATEKGHJRLJJ-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpXZtvZHRJy
Name 2,4-Hexanedione, 3,5-dimethyl-1-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-10(2)14(16)11(3)13(15)9-12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKey RSAATEKGHJRLJJ-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES c1cccc(CC(C(C(C(C)C)=O)C)=O)c1
SPLASH splash10-006x-9200000000-9959d4f0b4d3c38244a0
Synonyms 3,5-Dimethyl-1-phenyl-2,4-hexanedione 3,5-Dimethyl-1-phenyl-hexane-2,4-dione
Wiley ID 1491993