|
|
MOU-415 / 20:1 n-8 / c12-20:1 |
Names: Methyl (Z)-icos-12-enoate; (Z)-Icos-12-enoic acid methyl ester; (Z)-12-Icosenoic acid; 12Z-Icosenoic acid; cis-12-Icosenoic acid; Methyl (Z)-eicos-12-enoate; (Z)-Eicos-12-enoic acid methyl ester; (Z)-12-Eicosenoic acid; 12Z-Eicosenoic acid; cis-12-Eicosenoic acid
Formula: C21H40O2
Molar mass: 324.546 Da
Monoisotopic mass: 324.303 Da
SMILES: CCCCCCC/C=C\CCCCCCCCCCC(=O)OC
InChI Key: ASDWZPFNRWEQPR-KTKRTIGZSA-N
InChI: 1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h9-10H,3-8,11-20H2,1-2H3/b10-9-
Typical retention indexes:
- ECL on BPX70: 20.429
Names: (Z)-Icos-12-enoic acid; (Z)-12-Icosenoic acid; 12Z-Icosenoic acid; cis-12-Icosenoic acid; (Z)-Eicos-12-enoic acid; (Z)-12-Eicosenoic acid; 12Z-Eicosenoic acid; cis-12-Eicosenoic acid
Formula: C20H38O2
Molar mass: 310.519 Da
SMILES: CCCCCCC\C=C/CCCCCCCCCCC(O)=O
InChI Key: NCSORJRFQDBVHT-HJWRWDBZSA-N
InChI: 1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h8-9H,2-7,10-19H2,1H3,(H,21,22)/b9-8-
Lipid Maps code: LMFA01031296
|
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. |