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5-Phenylhexa-2,4-dienal
SpectraBase Compound ID 7EfxsHaTI5C
InChI InChI=1S/C12H12O/c1-11(7-5-6-10-13)12-8-3-2-4-9-12/h2-10H,1H3
InChIKey PGCCYRKGHJACDN-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJHRFtuUX6O
Name 5-Phenylhexa-2,4-dienal
Appearance Orange oil
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O
InChI InChI=1S/C12H12O/c1-11(7-5-6-10-13)12-8-3-2-4-9-12/h2-10H,1H3
InChIKey PGCCYRKGHJACDN-UHFFFAOYSA-N
Instrument Name Agilent 5975C-7890A
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202200671
Molecular Weight 172.227 g/mol
SMILES c1c(C(=CC=CC=O)C)cccc1
SPLASH splash10-0a6r-1900000000-9212ced55d9ba322051d
Sample Comments E/Z > 99:1
Source of Spectrum CCC-14-SM16-1p
Wiley ID 1876118