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SAN-014 / 23:0 / 23:0 |
Names: Methyl tricosanoate; Tricosanoic acid methyl ester
Formula: C24H48O2
Molar mass: 368.642 Da
Monoisotopic mass: 368.365 Da
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)OC
InChI Key: VORKGRIRMPBCCZ-UHFFFAOYSA-N
InChI: 1S/C24H48O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-23H2,1-2H3
Typical retention indexes:
- ECL on BPX70: 23.000
- ECL on Wax: 23.000
- ECL on DB225: 23.000
- ECL on 5% phenyl: 23.000
- ECL on Rxi-1: 23.000
- ECL on SLB-IL61: 23.000
- ECL on SLB-IL82: 23.000
- ECL on SLB-IL100: 23.000
- KI on Wax: 2936
- KI on DB225: 2913
- KI on 5% phenyl: 2631
Name: Tricosanoic acid
Formula: C23H46O2
Molar mass: 354.615 Da
SMILES: CCCCCCCCCCCCCCCCCCCCCCC(O)=O
InChI Key: XEZVDURJDFGERA-UHFFFAOYSA-N
InChI: 1S/C23H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2-22H2,1H3,(H,24,25)
ChEBI code: CHEBI:42394
Lipid Maps code: LMFA01010023
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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. |