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POU-050 / 18:3 n-4 / c8,c11,14-18:3 |
Names: Methyl (8Z,11Z,14Z)-octadeca-8,11,14-trienoate; (8Z,11Z,14Z)-Octadeca-8,11,14-trienoic acid methyl ester; (Z,Z,Z)-8,11,14-Octadecatrienoic acid methyl ester; 8Z,11Z,14Z-Octadecatrienoic acid methyl ester; cis-8, cis-11, cis-14-Octadecatrienoic acid methyl ester
Formula: C19H32O2
Molar mass: 292.461 Da
Monoisotopic mass: 292.240 Da
SMILES: CCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC
InChI Key: IDYSCTXABMOMMW-AGRJPVHOSA-N
InChI: 1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h5-6,8-9,11-12H,3-4,7,10,13-18H2,1-2H3/b6-5-,9-8-,12-11-
Typical retention indexes:
- ECL on BPX70: 19.731
- ECL on Wax: 19.133
- ECL on SLB-IL61: 18.940
- ECL on SLB-IL82: 19.999
- ECL on SLB-IL100: 20.337
- KI on Wax: 2537
Names: (8Z,11Z,14Z)-Octadeca-8,11,14-trienoic acid; (Z,Z,Z)-8,11,14-Octadecatrienoic acid; 8Z,11Z,14Z-Octadecatrienoic acid; cis-8, cis-11, cis-14-Octadecatrienoic acid
Formula: C18H30O2
Molar mass: 278.434 Da
SMILES: CCC\C=C/C/C=C\C\C=C/CCCCCCC(O)=O
InChI Key: CTMZJQAVRYEWHS-YSTUJMKBSA-N
InChI: 1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h4-5,7-8,10-11H,2-3,6,9,12-17H2,1H3,(H,19,20)/b5-4-,8-7-,11-10-
Lipid Maps code: LMFA02000350
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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. |