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MOU-423 / 22:1 n-8 / c14-22:1

Names: Methyl (Z)-docos-14-enoate;  (Z)-Docos-14-enoic acid methyl ester;  (Z)-14-Docosenoic acid methyl ester;  14Z-Docosenoic acid methyl ester;  cis-14-Docosenoic acid methyl ester

Formula: C23H44O2

Molar mass: 352.599 Da

Monoisotopic mass: 352.334 Da

SMILES: CCCCCCC/C=C\CCCCCCCCCCCCC(=O)OC

InChI Key: CEHAYHXJSQYDID-KTKRTIGZSA-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/h9-10H,3-8,11-22H2,1-2H3/b10-9-

Typical retention indexes:
- ECL on BPX70: 22.436

Non-derivatized:

Names: (Z)-Docos-14-enoic acid;  (Z)-14-Docosenoic acid;  14Z-Docosenoic acid;  cis-14-Docosenoic acid

Formula: C22H42O2

Molar mass: 338.573 Da

SMILES: CCCCCCC\C=C/CCCCCCCCCCCCC(O)=O

InChI Key: MTHLEQRYTJWJKJ-HJWRWDBZSA-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/h8-9H,2-7,10-21H2,1H3,(H,23,24)/b9-8-



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.