Mol:LBF13102SC01

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 15 14  0  0  0  0  0  0  0  0999 V2000 
    2.9439   -0.5851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5571   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.2721   -0.5658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5571    0.6731    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3389   -0.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7064   -0.5851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0546   -0.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3919   -0.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2448   -0.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8786   -0.5713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5359   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2082   -0.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9067   -0.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5764   -0.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.2721   -0.2317    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 
  2  4  2  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 
  1  5  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 11 12  1  0  0  0  0 
 10 11  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
S  SKP  5 
ID	LBF13102SC01 
FORMULA	C13H24O2 
EXACTMASS	212.17763001199998 
AVERAGEMASS	212.32845999999998 
SMILES	CC=CCCCCCCCCCC(O)=O 
M  END