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(8E)-8-(phenylmethylene)-2-oxocanone
SpectraBase Compound ID 43T7wqusVoK
InChI InChI=1S/C14H16O2/c15-14-10-6-2-5-9-13(16-14)11-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2/b13-11+
InChIKey KQJHGMPEOTWFCX-ACCUITESSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4u3pkf0cBa
Name (8E)-8-(phenylmethylene)-2-oxocanone
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O2
InChI InChI=1S/C14H16O2/c15-14-10-6-2-5-9-13(16-14)11-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2/b13-11+
InChIKey KQJHGMPEOTWFCX-ACCUITESSA-N
Molecular Weight 216.280 g/mol
SMILES c1(\C=C\2OC(CCCCC2)=O)ccccc1
SPLASH splash10-014i-0900000000-b4654328440ca36724a9
Source of Spectrum SK-25-2130-3
Synonyms (8E)-8-(phenylmethylidene)oxocan-2-one (8E)-8-benzaloxocan-2-one (8E)-8-benzylideneoxocan-2-one
Wiley ID 866774