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2,4-Pentadienal, 5-[2-[4-[2-(3-oxo-1-propenyl)phenyl]-1,3-butadiynyl]phenyl]-, (E,E,E)-
SpectraBase Compound ID 5Syy8YdbP6J
InChI InChI=1S/C24H16O2/c25-19-9-1-2-11-21-12-3-4-13-22(21)14-5-6-15-23-16-7-8-17-24(23)18-10-20-26/h1-4,7-13,16-20H/b9-1+,11-2+,18-10+
InChIKey QYAKDVGJTUUDDG-XGBAVAHGSA-N
Mol Weight 336.39 g/mol
Molecular Formula C24H16O2
Exact Mass 336.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7aDNvx8sDyS
Name 2,4-Pentadienal, 5-[2-[4-[2-(3-oxo-1-propenyl)phenyl]-1,3-butadiynyl]phenyl]-, (E,E,E)-
Alternate Name(s) (2E,4E)-5-[2-(4-{2-[(1E)-3-oxo-1-propenyl]phenyl}-1,3-butadiynyl)phenyl]-2,4-pentadienal 4,5: 10,11-dibenzo-2,12,14-hexadecatriene-6,8-diynedial
CAS Registry Number 107006-35-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16O2
InChI InChI=1S/C24H16O2/c25-19-9-1-2-11-21-12-3-4-13-22(21)14-5-6-15-23-16-7-8-17-24(23)18-10-20-26/h1-4,7-13,16-20H/b9-1+,11-2+,18-10+
InChIKey QYAKDVGJTUUDDG-XGBAVAHGSA-N
Molecular Weight 336.390 g/mol
SMILES C(C#Cc1c(\C=C\C=O)cccc1)#Cc1c(\C=C\C=C\C=O)cccc1
SPLASH splash10-0udi-0091000000-ee77a1cf0c0b2bceb2d3
Source of Spectrum AJ-59-2213-23
Wiley ID 1332832