LMFA07010570
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
    8.6547   10.1900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6547    9.3974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4474    8.7780    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4474    7.6212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7901    8.9369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9254    9.4454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.9369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5828    7.0514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7181    7.5852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8534    7.0514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5828    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  2  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  8 11  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010570

> <COMMON_NAME>
SFE 4:0(2Me)/4:0

> <SYSTEMATIC_NAME>
2-Methylbutyl butyrate

> <FORMULA>
C9H18O2

> <MASS>
158.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(4:0(2Me)/4:0)

> <INCHI_KEY>
MBZKQDXXFMITAC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C9H18O2/c1-4-6-9(10)11-7-8(3)5-2/h8H,4-7H2,1-3H3

> <SMILES>
O=C(CCC)OCC(C)CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
156490

> <ABBREVIATION>
SFE 9:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162627

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
38105

> <CITATION>
-

$$$$