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DIU-158 / 18:2 n-4 / c11,c14-18:2 |
Names: Methyl (11Z,14Z)-octadeca-11,14-dienoate; (11Z,14Z)-Octadeca-11,14-dienoic acid methyl ester; (Z,Z)-11,14-Octadecadienoic acid methyl ester; 11Z,14Z-Octadecadienoic acid methyl ester; cis-11, cis-14-Octadecadienoic acid methyl ester
Formula: C19H34O2
Molar mass: 294.476 Da
Monoisotopic mass: 294.256 Da
SMILES: CCC/C=C\C/C=C\CCCCCCCCCC(=O)OC
InChI Key: KXQNNBUXFKDSAX-AFJQJTPPSA-N
InChI: 1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h5-6,8-9H,3-4,7,10-18H2,1-2H3/b6-5-,9-8-
Typical retention indexes:
- ECL on BPX70: 19.263
- ECL on Wax: 18.844
- ECL on 5% phenyl: 17.822
- ECL on SLB-IL61: 18.758
- ECL on SLB-IL82: 19.489
- ECL on SLB-IL100: 19.739
- KI on Wax: 2508
- KI on 5% phenyl: 2110
Names: (11Z,14Z)-Octadeca-11,14-dienoic acid; (Z,Z)-11,14-Octadecadienoic acid; 11Z,14Z-Octadecadienoic acid; cis-11, cis-14-Octadecadienoic acid
Formula: C18H32O2
Molar mass: 280.450 Da
SMILES: CCC\C=C/C/C=C\CCCCCCCCCC(O)=O
InChI Key: ACYNXSLKOYLYFV-UTOQUPLUSA-N
InChI: 1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h4-5,7-8H,2-3,6,9-17H2,1H3,(H,19,20)/b5-4-,8-7-
Lipid Maps code: LMFA01030299
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Data are acquired on Agilent 5972, 5973 and 5975 instruments at Nofima, Institute of Marine Research and University of Bergen. Molecular structures are created in Open Babel. |