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MOU-258 / 18:1 n-5 / c13-18:1 |
Names: Methyl (Z)-octadec-13-enoate; (Z)-Octadec-13-enoic acid methyl ester; (Z)-13-Octadecenoic acid methyl ester; 13Z-Octadecenoic acid methyl ester; cis-13-Octadecenoic acid methyl ester
Formula: C19H36O2
Molar mass: 296.492 Da
Monoisotopic mass: 296.272 Da
SMILES: CCCC/C=C\CCCCCCCCCCCC(=O)OC
InChI Key: OPLQDSJPOHPOSZ-SREVYHEPSA-N
InChI: 1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h6-7H,3-5,8-18H2,1-2H3/b7-6-
Typical retention indexes:
- ECL on BPX70: 18.610
- ECL on Wax: 18.396
- ECL on 5% phenyl: 17.891
- ECL on SLB-IL61: 18.368
- ECL on SLB-IL82: 18.720
- ECL on SLB-IL100: 18.858
- KI on Wax: 2462
- KI on 5% phenyl: 2116
Names: (Z)-Octadec-13-enoic acid; (Z)-13-Octadecenoic acid; 13Z-Octadecenoic acid; cis-13-Octadecenoic acid
Formula: C18H34O2
Molar mass: 282.465 Da
SMILES: CCCC\C=C/CCCCCCCCCCCC(O)=O
InChI Key: BDLLSHRIFPDGQB-WAYWQWQTSA-N
InChI: 1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h5-6H,2-4,7-17H2,1H3,(H,19,20)/b6-5-
Lipid Maps code: LMFA01030290
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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. |