|
|
DIU-547 / 20:2 n-6 ct / c11,t14-20:2 |
Names: Methyl (11Z,14E)-icosa-11,14-dienoate; (11Z,14E)-Icosa-11,14-dienoic acid methyl ester; (Z,E)-11,14-Icosadienoic acid methyl ester; 11Z,14E-Icosadienoic acid methyl ester; cis-11, trans-14-Icosadienoic acid methyl ester; Methyl (11Z,14E)-eicosa-11,14-dienoate; (11Z,14E)-Eicosa-11,14-dienoic acid methyl ester; (Z,E)-11,14-Eicosadienoic acid methyl ester; 11Z,14E-Eicosadienoic acid methyl ester; cis-11, trans-14-Eicosadienoic acid methyl ester
Formula: C21H38O2
Molar mass: 322.530 Da
Monoisotopic mass: 322.287 Da
SMILES: CCCCC\C=C\C\C=C/CCCCCCCCCC(=O)OC
InChI Key: GWJCFAOQCNNFAM-LFOHPMNASA-N
InChI: 1S/C21H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h7-8,10-11H,3-6,9,12-20H2,1-2H3/b8-7+,11-10-
Typical retention indexes:
- ECL on BPX70: 20.867
Names: (11Z,14E)-icosa-11,14-dienoic acid; (Z,E)-11,14-Icosadienoic acid; 11Z,14E-Icosadienoic acid; cis-11, trans-14-Icosadienoic acid; (11Z,14E)-eicosa-11,14-dienoic acid; (Z,E)-11,14-Eicosadienoic acid; 11Z,14E-Eicosadienoic acid; cis-11, trans-14-Eicosadienoic acid
Formula: C20H36O2
Molar mass: 308.503 Da
SMILES: CCCCC\C=C\C\C=C/CCCCCCCCCC(O)=O
InChI Key: XSXIVVZCUAHUJO-KQHSAVHASA-N
InChI: 1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,21,22)/b7-6+,10-9-
|
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. |