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4-Methylhepta-2,4-dienal
SpectraBase Compound ID 5uOS3Ujmwzn
InChI InChI=1S/C8H12O/c1-3-5-8(2)6-4-7-9/h4-7H,3H2,1-2H3
InChIKey DZILTIIQBGJDEO-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Gy7B3tg4cB
Name 4-Methylhepta-2,4-dienal
Appearance Yellow oil
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-3-5-8(2)6-4-7-9/h4-7H,3H2,1-2H3
InChIKey DZILTIIQBGJDEO-UHFFFAOYSA-N
Instrument Name Agilent 5975C-7890A
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202200671
Molecular Weight 124.183 g/mol
SMILES C(C=C(C=CC=O)C)C
SPLASH splash10-0002-9100000000-f741550e880a99cb3a26
Sample Comments (2E,4E)/(2E,4Z) = 91:9
Source of Spectrum CCC-14-SM11-1b
Wiley ID 1876106