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SOH-225 / 14:0-3OH / 3-Hydroxytetradecanoic acid ME

Names: Methyl 3-hydroxytetradecanoate;  3-Hydroxytetradecanoic acid methyl ester

Formula: C15H30O3

Molar mass: 258.400 Da

Monoisotopic mass: 258.219 Da

SMILES: CCCCCCCCCCCC(O)CC(=O)OC

InChI Key: UOZZAMWODZQSOA-UHFFFAOYSA-N

InChI: 1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-14(16)13-15(17)18-2/h14,16H,3-13H2,1-2H3

Typical retention indexes:
- ECL on BPX70: 19.458
- ECL on BP20: 18.694
- ECL on DB225: 17.633

Non-derivatized:

Names: 3-Hydroxytetradecanoic acid;  3-Hydroxymyristic acid

Formula: C14H28O3

Molar mass: 244.373 Da

SMILES: CCCCCCCCCCCC(O)CC(O)=O

InChI Key: ATRNZOYKSNPPBF-UHFFFAOYSA-N

InChI: 1S/C14H28O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)

Lipid Maps code: LMFA01050175



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.