|
|
MOU-026 / 24:1 n-9 / c15-24:1 |
Names: Methyl (Z)-tetracos-15-enoate; (Z)-Tetracos-15-enoic acid methyl ester; (Z)-15-Tetracosenoic acid methyl ester; 15Z-Tetracosenoic acid methyl ester; cis-15-Tetracosenoic acid methyl ester; Methyl nervonate; Nervonic acid methyl ester; Selacholeic acid methyl ester
Formula: C25H48O2
Molar mass: 380.653 Da
Monoisotopic mass: 380.365 Da
SMILES: CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OC
InChI Key: AINIZSBLAFHZCP-KHPPLWFESA-N
InChI: 1S/C25H48O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-2/h10-11H,3-9,12-24H2,1-2H3/b11-10-
Typical retention indexes:
- ECL on BPX70: 24.410
- ECL on Wax: 24.210
- ECL on DB225: 24.213
- ECL on 5% phenyl: 23.749
- ECL on Rxi-1: 23.705
- ECL on SLB-IL61: 24.212
- ECL on SLB-IL82: 24.535
- ECL on SLB-IL100: 24.625
- KI on 5% phenyl: 2706
Names: (Z)-Tetracos-15-enoic acid; (Z)-15-Tetracosenoic acid; 15Z-Tetracosenoic acid; cis-15-Tetracosenoic acid; Nervonic acid; Selacholeic acid
Formula: C24H46O2
Molar mass: 366.626 Da
SMILES: CCCCCCCC\C=C/CCCCCCCCCCCCCC(O)=O
InChI Key: GWHCXVQVJPWHRF-KTKRTIGZSA-N
InChI: 1S/C24H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h9-10H,2-8,11-23H2,1H3,(H,25,26)/b10-9-
ChEBI code: CHEBI:44247
Lipid Maps code: LMFA01030092
|
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. |