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3-[(E)-2-phenylethenyl]pentane-2,4-dione
SpectraBase Compound ID IiqSeINFoFc
InChI InChI=1S/C13H14O2/c1-10(14)13(11(2)15)9-8-12-6-4-3-5-7-12/h3-9,13H,1-2H3/b9-8+
InChIKey PUOYNAISAJFCDN-CMDGGOBGSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lwN2qoTOxk
Name 3-[(E)-2-phenylethenyl]pentane-2,4-dione
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-10(14)13(11(2)15)9-8-12-6-4-3-5-7-12/h3-9,13H,1-2H3/b9-8+
InChIKey PUOYNAISAJFCDN-CMDGGOBGSA-N
Molecular Weight 202.253 g/mol
SMILES C(\C=C\c1ccccc1)(C(=O)C)C(=O)C
SPLASH splash10-004i-0930000000-754a498d1962297d1c93
Source of Spectrum D1-2006-1722-0
Synonyms 3-[(E)-styryl]pentane-2,4-dione
Wiley ID 1614121