CDK     1023151740

  6  5  0  0  0  0  0  0  0  0999 V2000
    1.2375    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    1.4289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    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 
  4  6  1  0  0  0  0 
M  END
> <ID>
CHEBI:88374

> <NAME>
2-Methylpentane

> <STAR>
2

> <SYNONYM>
2-methylpentane; 2-Methyl-pentane

> <FORMULA>
C6H14

> <MASS>
86.176

> <MONOISOTOPIC_MASS>
86.10955

> <CHARGE>
0

> <SMILES>
CCCC(C)C

> <INCHI>
InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3

> <INCHIKEY>
AFABGHUZZDYHJO-UHFFFAOYSA-N

> <WIKIPEDIA_ACCESSION>
2-Methylpentane

> <PUBMED_CITATION>
10537374; 17314143; 24421258; 422277

$$$$