Mol:LBF08000HO04

Copyright: ARM project http://www.metabolome.jp/

11 10  0  0  0  0  0  0  0  0999 V2000 
   1.7837   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.4984   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.2129   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.4984    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0691   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.3545   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.3598   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.0743   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.7864   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.4984   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.2129   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 2  4  2  0 
 1  5  1  0 
 5  6  1  0 
 6  7  1  0 
 7  8  1  0 
 8  9  1  0 
 9 10  1  0 
10 11  1  0 

S SKP 6 ID LBF08000HO04 FORMULA C8H16O3 EXACTMASS 160.109944378 AVERAGEMASS 160.21084 SMILES OCCCCCCCC(O)=O AUTODRAW FALSE M END