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1-Phenylhepta-1,2-dien-4-one
SpectraBase Compound ID 4cHsUFPqXoR
InChI InChI=1S/C13H14O/c1-2-7-13(14)11-6-10-12-8-4-3-5-9-12/h3-5,8-11H,2,7H2,1H3
InChIKey DTYVEGQWSDWGCY-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BraFRomToUV
Name 1-Phenylhepta-1,2-dien-4-one
Alternate Name(s) 1-phenyl-4-hepta-1,2-dienone
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O
InChI InChI=1S/C13H14O/c1-2-7-13(14)11-6-10-12-8-4-3-5-9-12/h3-5,8-11H,2,7H2,1H3
InChIKey DTYVEGQWSDWGCY-UHFFFAOYSA-N
Molecular Weight 186.254 g/mol
SMILES C(=C=CC(CCC)=O)c1ccccc1
SPLASH splash10-00di-9100000000-5e97ca4e1f72eb99b5f7
Source of Spectrum QF-9-2452-1
Wiley ID 1558444