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MOU-083 / 20:1 n-15 / c5-20:1

Names: Methyl (Z)-Icos-5-enoate;  (Z)-Icos-5-enoic acid methyl ester;  (Z)-5-Icosenoic acid methyl ester;  5Z-Icosenoic acid methyl ester;  cis-5-Icosenoic acid methyl ester;  Methyl (Z)-Eicos-5-enoate;  (Z)-Eicos-5-enoic acid methyl ester;  (Z)-5-Eicosenoic acid methyl ester;  5Z-Eicosenoic acid methyl ester;  cis-5-Eicosenoic acid methyl ester

Formula: C21H40O2

Molar mass: 324.546 Da

Monoisotopic mass: 324.303 Da

SMILES: CCCCCCCCCCCCCC/C=C\CCCC(=O)OC

InChI Key: DCELZGFMHKOOJH-MSUUIHNZSA-N

InChI: 1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h16-17H,3-15,18-20H2,1-2H3/b17-16-

Typical retention indexes:
- ECL on BPX70: 20.217
- ECL on BP20: 20.111

Non-derivatized:

Names: (Z)-Icos-5-enoic acid;  (Z)-5-Icosenoic acid;  5Z-Icosenoic acid;  cis-5-Icosenoic acid;  (Z)-Eicos-5-enoic acid;  (Z)-5-Eicosenoic acid;  5Z-Eicosenoic acid;  cis-5-Eicosenoic acid

Formula: C20H38O2

Molar mass: 310.519 Da

SMILES: CCCCCCCCCCCCCC\C=C/CCCC(O)=O

InChI Key: FPAQLJHSZVFKES-NXVVXOECSA-N

InChI: 1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h15-16H,2-14,17-19H2,1H3,(H,21,22)/b16-15-

Lipid Maps code: LMFA01030371



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.