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SAN-321 / 7:0 / 7:0 |
Names: Methyl heptanoate; Heptanoic acid methyl ester; Enanthic acid methyl ester; Methyl enanthate
Formula: C8H16O2
Molar mass: 144.213 Da
Monoisotopic mass: 144.115 Da
SMILES: CCCCCCC(=O)OC
InChI Key: XNCNNDVCAUWAIT-UHFFFAOYSA-N
InChI: 1S/C8H16O2/c1-3-4-5-6-7-8(9)10-2/h3-7H2,1-2H3
Lipid Maps code: LMFA07010961
Typical retention indexes:
- ECL on BPX70: 7.000
Names: Heptanoic acid; Enanthic acid
Formula: C7H14O2
Molar mass: 130.186 Da
SMILES: CCCCCCC(O)=O
InChI Key: MNWFXJYAOYHMED-UHFFFAOYSA-N
InChI: 1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)
ChEBI code: CHEBI:45571
Lipid Maps code: LMFA01010007
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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. |