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5-(4-Methylphenyl)penta-3,4-dien-2-one
SpectraBase Compound ID Azm06VHuQPG
InChI InChI=1S/C12H12O/c1-10-6-8-12(9-7-10)5-3-4-11(2)13/h4-9H,1-2H3
InChIKey SSAYYTCXVOFOCG-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EdwJzNgds8
Name 5-(4-Methylphenyl)penta-3,4-dien-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O
InChI InChI=1S/C12H12O/c1-10-6-8-12(9-7-10)5-3-4-11(2)13/h4-9H,1-2H3
InChIKey SSAYYTCXVOFOCG-UHFFFAOYSA-N
Molecular Weight 172.227 g/mol
SMILES CC(C=C=Cc1ccc(cc1)C)=O
SPLASH splash10-00dl-7900000000-e3028b239e662a5767e2
Source of Spectrum HE-1999-1238-3
Synonyms 5-(4-methylphenyl)-3,4-pentadien-2-one
Wiley ID 1613504