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MOU-084 / 22:1 n-11 / c11-22:1

Names: Methyl (Z)-docos-11-enoate;  (Z)-Docos-11-enoic acid methyl ester;  (Z)-11-Docosenoic acid methyl ester;  11Z-Docosenoic acid methyl ester;  cis-11-Docosenoic acid methyl ester;  Cetoleic acid methyl ester

Formula: C23H44O2

Molar mass: 352.599 Da

Monoisotopic mass: 352.334 Da

SMILES: CCCCCCCCCC/C=C\CCCCCCCCCC(=O)OC

InChI Key: QIZZORAOGOPHQF-SEYXRHQNSA-N

InChI: 1S/C23H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h12-13H,3-11,14-22H2,1-2H3/b13-12-

Typical retention indexes:
- ECL on BP20: 22.129

Non-derivatized:

Names: (Z)-Docos-11-enoic acid;  (Z)-11-Docosenoic acid;  11Z-Docosenoic acid methyl ester;  cis-11-Docosenoic acid methyl ester;  Cetoleic acid;  Cetoleic acid

Formula: C22H42O2

Molar mass: 338.573 Da

SMILES: CCCCCCCCCC\C=C/CCCCCCCCCC(O)=O

InChI Key: KJDZDTDNIULJBE-QXMHVHEDSA-N

InChI: 1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h11-12H,2-10,13-21H2,1H3,(H,23,24)/b12-11-

ChEBI code: CHEBI:32428

Lipid Maps code: LMFA01030088



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.