|
|
MOU-407 / 16:1 n-4 / c12-16:1 |
Names: Methyl (Z)-hexadec-12-enoate; (Z)-Hexadec-12-enoic acid methyl ester; (Z)-12-Hexadecenoic acid methyl ester; 12Z-Hexadecenoic acid methyl ester; cis-12-Hexadecenoic acid methyl ester
Formula: C17H32O2
Molar mass: 268.439 Da
Monoisotopic mass: 268.240 Da
SMILES: CCC/C=C\CCCCCCCCCCC(=O)OC
InChI Key: FAEDWEWSKPMOOP-WAYWQWQTSA-N
InChI: 1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h5-6H,3-4,7-16H2,1-2H3/b6-5-
Typical retention indexes:
- ECL on BPX70: 16.673
- ECL on Wax: 16.464
- KI on Wax: 2264
Names: (Z)-hexadec-12-enoic acid; (Z)-12-Hexadecenoic acid; 12Z-Hexadecenoic acid; cis-12-Hexadecenoic acid
Formula: C16H30O2
Molar mass: 254.412 Da
SMILES: CCC\C=C/CCCCCCCCCCC(O)=O
InChI Key: MAJQLUHZSRVCAT-PLNGDYQASA-N
InChI: 1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h4-5H,2-3,6-15H2,1H3,(H,17,18)/b5-4-
Lipid Maps code: LMFA01031280
|
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. |