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13-OXO-9-(Z),11-(E)-OCTADECDIENOIC_ACID
SpectraBase Compound ID LskJsCkk9lj
InChI InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+
InChIKey JHXAZBBVQSRKJR-BSZOFBHHSA-N
Mol Weight 294.43 g/mol
Molecular Formula C18H30O3
Exact Mass 294.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bYZsoyecoN
Name [(9Z,11E)-13-Oxo-octadecadienoic acid]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O3
InChI InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+
InChIKey JHXAZBBVQSRKJR-BSZOFBHHSA-N
Ionization Type EI
Molecular Weight 294.435 g/mol
SMILES OC(CCCCCCC\C=C/C=C/C(CCCCC)=O)=O
SPLASH splash10-0gc1-9840000000-7f61bb592e71409025a4
Source of Spectrum JP5144540B2
Wiley ID 1852353