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SOH-708 / 18:0-12OH / 12-Hydroxyoctadecanoic acid ME

Names: Methyl 12-hydroxyoctadecanoate;  12-Hydroxyoctadecanoic acid methyl ester;  Methyl-12-hydroxystearate;  12-Hydroxystearic acid methyl ester

Formula: C19H38O3

Molar mass: 314.507 Da

Monoisotopic mass: 314.282 Da

SMILES: CCCCCCC(CCCCCCCCCCC(=O)OC)O

InChI Key: RVWOWEQKPMPWMQ-UHFFFAOYSA-N

InChI: 1S/C19H38O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h18,20H,3-17H2,1-2H3

Typical retention indexes:
- ECL on BPX70: 25.412
- ECL on BP20: 23.838
- ECL on DB225: 22.994

Non-derivatized:

Names: 12-Hydroxyoctadecanoic acid;  12-Hydroxystearic acid

Formula: C18H36O3

Molar mass: 300.481 Da

SMILES: CCCCCCC(O)CCCCCCCCCCC(O)=O

InChI Key: ULQISTXYYBZJSJ-UHFFFAOYSA-N

InChI: 1S/C18H36O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h17,19H,2-16H2,1H3,(H,20,21)

Lipid Maps code: LMFA01050064



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.