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DIU-095 / 22:2 NMI / c7,c15-22:2 |
Names: Methyl (7Z,15Z)-docosa-7,15-dienoate; (7Z,15Z)-Docosa-7,15-dienoic acid methyl ester; (Z,Z)-7,15-Docosadienoic acid methyl ester; 7Z,15Z-Docosadienoic acid methyl ester; cis-7, cis-15-Docosadienoic acid methyl ester
Formula: C23H42O2
Molar mass: 350.584 Da
Monoisotopic mass: 350.318 Da
SMILES: CCCCCC/C=C\CCCCCC/C=C\CCCCCC(=O)OC
InChI Key: HKBWLLKAUFGBQW-GYVPIYKOSA-N
InChI: 1S/C23H42O2/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/h8-9,16-17H,3-7,10-15,18-22H2,1-2H3/b9-8-,17-16-
Typical retention indexes:
- ECL on BPX70: 22.782
- ECL on Wax: 22.417
- ECL on 5% phenyl: 21.526
- ECL on SLB-IL100: 20.107
- KI on Wax: 2875
- KI on 5% phenyl: 2482
Names: (7Z,15Z)-Docosa-7,15-dienoic acid; (Z,Z)-7,15-Docosadienoic acid; 7Z,15Z-Docosadienoic acid; cis-7, cis-15-Docosadienoic acid
Formula: C22H40O2
Molar mass: 336.557 Da
SMILES: CCCCCC\C=C/CCCCCC\C=C/CCCCCC(O)=O
InChI Key: MGODENBPAJYNPY-DRGLTMLKSA-N
InChI: 1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h7-8,15-16H,2-6,9-14,17-21H2,1H3,(H,23,24)/b8-7-,16-15-
Lipid Maps code: LMFA01030861
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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. |