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(2E,4E)-2,4-hexadienoic acid
SpectraBase Compound ID KiBYQ4bZs2h
InChI InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+
InChIKey WSWCOQWTEOXDQX-MQQKCMAXSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ByuDylqSpB
Name (2E,4E)-2,4-hexadienoic acid
Alternate Name(s) Sorbic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c1-2-3-4-5-6(7)8/h2-5H,1H3,(H,7,8)/b3-2+,5-4+
InChIKey WSWCOQWTEOXDQX-MQQKCMAXSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.2740230611
Molecular Weight 112.128 g/mol
SMILES OC(\C=C\C=C\C)=O
SPLASH splash10-014s-9000000000-d470d1de8af8a68d5366
Source of Spectrum SFA-23-775-I
Wiley ID 1856592