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4,6-Octadienoic acid

View entire compound with spectra: 3 MS (GC)

4,6-Octadienoic acid
SpectraBase Compound ID FwcqPUvPKQZ
InChI InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H,6-7H2,1H3,(H,9,10)/b3-2+,5-4+
InChIKey GVKGXDFZFAFBIW-MQQKCMAXSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41rbujhWlqS
Name 4,6-Octadienoic acid, (E,E)-
Alternate Name(s) 4,5-Octadienoic acid
CAS Registry Number 75283-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H,6-7H2,1H3,(H,9,10)/b3-2+,5-4+
InChIKey GVKGXDFZFAFBIW-MQQKCMAXSA-N
Molecular Weight 140.182 g/mol
SMILES OC(=O)CC\C=C\C=C\C
SPLASH splash10-005c-9100000000-ee91a72e2bebe444d24a
Source of Spectrum J-45-5024-0
Wiley ID 1139233