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1-(4-Cyanophenyl)hexa-1,4-dien-3-one
SpectraBase Compound ID 1Wjec7CmBss
InChI InChI=1S/C13H11NO/c1-2-3-13(15)9-8-11-4-6-12(10-14)7-5-11/h2-9H,1H3/b3-2+,9-8+
InChIKey FQQHCHSSQMTMBU-VHYPUYLQSA-N
Mol Weight 197.24 g/mol
Molecular Formula C13H11NO
Exact Mass 197.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AACfHYZLzA0
Name 1-(4-Cyanophenyl)hexa-1,4-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO
InChI InChI=1S/C13H11NO/c1-2-3-13(15)9-8-11-4-6-12(10-14)7-5-11/h2-9H,1H3/b3-2+,9-8+
InChIKey FQQHCHSSQMTMBU-VHYPUYLQSA-N
Molecular Weight 197.237 g/mol
SMILES C(\C=C\c1ccc(cc1)C#N)(\C=C\C)=O
SPLASH splash10-000i-9000000000-0ba6b51c54bc43b4f4f2
Source of Spectrum QE-12-9091-3
Synonyms 4-[(1E,4E)-3-oxo-1,4-hexadienyl]benzonitrile
Wiley ID 1587416