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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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7wjmsgvuhdE
Name Sorbic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number H8307
CAS Registry Number 110-44-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 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
Observed nucleus 13C
Purity 97%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-trans-gamma-trans-Sorbic acid (E,E)-1,3-Pentadiene-1-carboxylic acid 2,4-Hexadienoic acid 2E,4E-Hexadienoic acid trans,trans-2,4-Hexadienoic acid
Wiley ID SIAL_13CNMR_012104