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Linolenic acid ethyl ester
SpectraBase Compound ID Ac79K28uU3O
InChI InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
InChIKey JYYFMIOPGOFNPK-AGRJPVHOSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JdU8lJkBzk
Name Ethyl linolenate
CAS Registry Number 1191-41-9
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 306.255880333 u
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
InChIKey JYYFMIOPGOFNPK-AGRJPVHOSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 306.490 g/mol
Nominal Mass 306 u
Quality 876
Retention Index 2155
SMILES C(CCCCCCC\C=C/C\C=C/C\C=C/CC)(OCC)=O
SPLASH splash10-05po-9400000000-360d9c0365c7db8c5da7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Ethyl 9,12,15-octadecatrienoate
Technique GC/MS
Wiley ID DD2024_025367