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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

Typical retention indexes:
- ECL on BPX70: 17.000
- ECL on BP20: 17.000
- ECL on DB225: 17.000
- ECL on SLB-IL61: 17.000
- ECL on SLB-IL82: 17.000
- ECL on SLB-IL100: 17.000

Non-derivatized:

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



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.