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SAN-008 / 17:0 / 17:0 |
Names: Methyl heptadecanoate; Heptadecanoic acid methyl ester; Margaric acid methyl ester; Methyl margarate
Formula: C18H36O2
Molar mass: 284.481 Da
Monoisotopic mass: 284.272 Da
SMILES: CCCCCCCCCCCCCCCCC(=O)OC
InChI Key: HUEBIMLTDXKIPR-UHFFFAOYSA-N
InChI: 1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3
Lipid Maps code: LMFA07010473
Typical retention indexes:
- ECL on BPX70: 17.000
- ECL on Wax: 17.000
- ECL on DB225: 17.000
- ECL on 5% phenyl: 17.000
- ECL on Rxi-1: 17.000
- ECL on SLB-IL61: 17.000
- ECL on SLB-IL82: 17.000
- ECL on SLB-IL100: 17.000
- KI on Wax: 2319
- KI on DB225: 2287
- KI on 5% phenyl: 2027
Names: Heptadecanoic acid; Margaric acid
Formula: C17H34O2
Molar mass: 270.454 Da
SMILES: CCCCCCCCCCCCCCCCC(O)=O
InChI Key: KEMQGTRYUADPNZ-UHFFFAOYSA-N
InChI: 1S/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19)
ChEBI code: CHEBI:32365
Lipid Maps code: LMFA01010017
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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. |