Mol:LBF15000OX01

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

18 17  0  0  0  0  0  0  0  0999 V2000 
   2.5006   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.2151    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.9296   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6441    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.3585   -0.2063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.6441    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.7862    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.0717   -0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.3572    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.3572   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.0717    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.7862   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5006    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.2151   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.9296    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.6441   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.5006   -1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.3585    0.2063    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  2  0  0  0  0 
 1  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 
11 12  1  0  0  0  0 
12 13  1  0  0  0  0 
13 14  1  0  0  0  0 
14 15  1  0  0  0  0 
15 16  1  0  0  0  0 
 1 17  2  0  0  0  0 
16 18  1  0  0  0  0 

S SKP 6 ID LBF15000OX01 FORMULA C15H28O3 EXACTMASS 256.203844762 AVERAGEMASS 256.38102000000003 SMILES CCCCCCCCCCCC(=O)CCC(O)=O AUTODRAW FALSE M END