www.chrombox.org

DIU-091 / 16:2 n-7 / c6,c9-16:2

Names: Methyl (6Z,9Z)-hexadeca-6,9-dienoate;  (6Z,9Z)-Hexadeca-6,9-dienoic acid methyl ester;  (Z,Z)-6,9-Hexadecadienoic acid methyl ester;  6Z,9Z-Hexadecadienoic acid methyl ester;  cis-6, cis-9-Hexadecadienoic acid methyl ester

Formula: C17H30O2

Molar mass: 266.423 Da

Monoisotopic mass: 266.225 Da

SMILES: CCCCCC/C=C\C/C=C\CCCCC(=O)OC

InChI Key: NQEJQTZZCIXARK-MURFETPASA-N

InChI: 1S/C17H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h8-9,11-12H,3-7,10,13-16H2,1-2H3/b9-8-,12-11-

Typical retention indexes:
- ECL on BPX70: 16.961
- ECL on BP20: 16.600
- ECL on DB225: 16.463
- ECL on SLB-IL61: 16.401
- ECL on SLB-IL82: 17.072
- ECL on SLB-IL100: 17.265

Non-derivatized:

Names: (6Z,9Z)-Hexadeca-6,9-dienoic acid;  (Z,Z)-6,9-Hexadecadienoic acid;  6Z,9Z-Hexadecadienoic acid;  cis-6, cis-9-Hexadecadienoic acid

Formula: C16H28O2

Molar mass: 252.396 Da

SMILES: CCCCCC\C=C/C/C=C\CCCCC(O)=O

InChI Key: JZJWNDAFHKZSNQ-NQLNTKRDSA-N

InChI: 1S/C16H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8,10-11H,2-6,9,12-15H2,1H3,(H,17,18)/b8-7-,11-10-

Lipid Maps code: LMFA01030273



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.