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cis, cis-9,12-Octadecadienoic acid
SpectraBase Compound ID K2IvwUhDzfD
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YaqnW2p0SV
Name Linoleic acid
CAS Registry Number 60-33-3
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 280.240230268 u
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
InChIKey OYHQOLUKZRVURQ-HZJYTTRNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 280.452 g/mol
Nominal Mass 280 u
Quality 999
Retention Index 1967
SMILES OC(CCCCCCC\C=C/C\C=C/CCCCC)=O
SPLASH splash10-015a-9100000000-649267c4525f95fcae26
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (Z,Z)-9,12-octadecadienoic acid
Technique GC/MS
Wiley ID DD2024_022728