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SAN-019 / 28:0 / 28:0 |
Names: Methyl octacosanoate; Octacosanoic acid methyl ester; Montanic acid methyl ester; Methyl montanate
Formula: C29H58O2
Molar mass: 438.776 Da
Monoisotopic mass: 438.444 Da
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC
InChI Key: ZKHOYAKAFALNQD-UHFFFAOYSA-N
InChI: 1S/C29H58O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(30)31-2/h3-28H2,1-2H3
Typical retention indexes:
- ECL on BPX70: 28.000
- ECL on Wax: 28.000
- ECL on 5% phenyl: 28.000
- ECL on SLB-IL82: 28.000
- ECL on SLB-IL100: 28.000
Names: Octacosanoic acid; Montanic acid
Formula: C28H56O2
Molar mass: 424.749 Da
SMILES: CCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)=O
InChI Key: UTOPWMOLSKOLTQ-UHFFFAOYSA-N
InChI: 1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)
ChEBI code: CHEBI:31001
Lipid Maps code: LMFA01010028
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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. |