LMFA12000252
  LIPID_MAPS_STRUCTURE_DATABASE

 14 13  0  0  0  0  0  0  0  0999 V2000
   12.4954    6.0409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7461    5.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9966    6.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2470    5.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4974    6.0408    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.7479    5.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9983    6.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2488    5.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4991    6.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7496    5.6114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7479    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4974    6.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2456    7.0841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  5 13  1  0  0  0  0
  6 12  2  0  0  0  0
 13 14  1  0  0  0  0
M  END
> <LM_ID>
LMFA12000252

> <COMMON_NAME>
5-Ethylundecan-6-one

> <SYSTEMATIC_NAME>
5-Ethylundecan-6-one

> <FORMULA>
C13H26O

> <MASS>
198.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Oxygenated hydrocarbons [FA12]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KALOYZXPKPLLLM-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C13H26O/c1-4-7-9-11-13(14)12(6-3)10-8-5-2/h12H,4-11H2,1-3H3

> <SMILES>
CCCCC(CC)C(=O)CCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11651325

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$