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MOU-356 / 13:1 n-1 / 12-13:1

Names: Methyl tridec-12-enoate;  Tridec-12-enoic acid methyl ester;  12-Tridecenoic acid methyl ester

Formula: C14H26O2

Molar mass: 226.358 Da

Monoisotopic mass: 226.193 Da

SMILES: C=CCCCCCCCCCCC(=O)OC

InChI Key: LCAVRNOMCURXMM-UHFFFAOYSA-N

InChI: 1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-14(15)16-2/h3H,1,4-13H2,2H3

Typical retention indexes:
- ECL on BPX70: 13.709
- ECL on BP20: 13.544

Non-derivatized:

Names: Tridec-12-enoic acid;  12-Tridecenoic acid

Formula: C13H24O2

Molar mass: 212.331 Da

SMILES: OC(=O)CCCCCCCCCCC=C

InChI Key: PARCICAYFORNPH-UHFFFAOYSA-N

InChI: 1S/C13H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2H,1,3-12H2,(H,14,15)

Lipid Maps code: LMFA01030046



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.