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SAB-073 / ai-17:0 / 14-Methylhexadecanoic acid ME |
Names: Methyl 14-methylhexadecanoate; 14-methylhexadecanoic acid methyl ester; 14-Methylpalmitic acid methyl ester
Formula: C18H36O2
Molar mass: 284.481 Da
Monoisotopic mass: 284.272 Da
SMILES: CCC(C)CCCCCCCCCCCCC(=O)OC
InChI Key: AOAFVSVYRSUDBN-UHFFFAOYSA-N
InChI: 1S/C18H36O2/c1-4-17(2)15-13-11-9-7-5-6-8-10-12-14-16-18(19)20-3/h17H,4-16H2,1-3H3
Lipid Maps code: LMFA07010527
Typical retention indexes:
- ECL on BPX70: 16.714
- ECL on Wax: 16.676
- ECL on 5% phenyl: 16.715
- ECL on Rxi-1: 16.722
- ECL on SLB-IL61: 16.733
- ECL on SLB-IL82: 16.748
- ECL on SLB-IL100: 16.783
- KI on Wax: 2286
- KI on 5% phenyl: 1998
Names: 14-methylhexadecanoic acid; 14-Methylpalmitic acid
Formula: C17H34O2
Molar mass: 270.454 Da
SMILES: CCC(C)CCCCCCCCCCCCC(O)=O
InChI Key: FXUKWLSZZHVEJD-UHFFFAOYSA-N
InChI: 1S/C17H34O2/c1-3-16(2)14-12-10-8-6-4-5-7-9-11-13-15-17(18)19/h16H,3-15H2,1-2H3,(H,18,19)
Lipid Maps code: LMFA01020011
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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. |