Linolenic acid ethyl ester

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Systematic / IUPAC Name: Ethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

ID: Reference6600

Other Names: (9Z,12Z,15Z)Ethyl octadeca-9,12,15-trienoate;
9,12,15-Octadecatrienoic acid, ethyl ester, (Z,Z,Z)-;
9,12,15-Octadecatrienoic acid, ethyl ester, (9Z,12Z,15Z)-;
Ethyl α-linolenate;
Ethyl (Z,Z,Z)-9,12,15-octadecatrienoate ; more

Formula: C20H34O2

Spectral Data

Linolenic acid ethyl ester mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 4116
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 7/10/2017 8:51:31 AM
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Identificators

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-
InChI Key JYYFMIOPGOFNPK-AGRJPVHOSA-N
Canonical SMILES CCC=CCC=CCC=CCCCCCCCC(=O)OCC
CAS 1191419
Splash
Other Names (9Z,12Z,15Z)Ethyl octadeca-9,12,15-trienoate;
9,12,15-Octadecatrienoic acid, ethyl ester, (Z,Z,Z)-;
9,12,15-Octadecatrienoic acid, ethyl ester, (9Z,12Z,15Z)-;
Ethyl α-linolenate;
Ethyl (Z,Z,Z)-9,12,15-octadecatrienoate;
Ethyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate;
Ethyl (9Z,12Z,15Z)-octadecatrienoate;
Ethyl cis-,cis-,cis-9,12,15-octadecatrienoate;
Linolenic acid, ethyl ester;
Ethyl linolenate

In Other Databases

ChemSpider 4518967
ChEBI CHEBI:84851
ChEMBL CHEMBL2005772
PubChem 5367460