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trans,trans-2,4-OCTADIENAL
SpectraBase Compound ID CHscaItZltx
InChI InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h4-8H,2-3H2,1H3/b5-4+,7-6+
InChIKey DVVATNQISMINCX-YTXTXJHMSA-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 6iB7kvIiiQi
Name 2,4-OCTADIENAL, (E,E)-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 124.088815005 u
Formula C8H12O
InChI InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h4-8H,2-3H2,1H3/b5-4+,7-6+
InChIKey DVVATNQISMINCX-YTXTXJHMSA-N
Molecular Weight 124.183 g/mol
Nominal Mass 124 u
Number of Peaks 62
SMILES CCC\C=C\C=C\C=O
SPLASH splash10-001i-9000000000-acb6172f45100596a0cd
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000554