Mol:LBF08103BC01

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

11 10  0  0  0  0  0  0  0  0999 V2000 
   1.4842   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.1989   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9133   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.1989    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7696   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.0551   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.6594   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4844   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.1988   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9133   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4844    0.6187    0.0000 C   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  2  0 
 8  9  1  0 
 9 10  1  0 
 8 11  1  0 

S SKP 6 ID LBF08103BC01 FORMULA C9H16O2 EXACTMASS 156.11502975599998 AVERAGEMASS 156.22214 SMILES CCC(C)=CCCCC(O)=O AUTODRAW FALSE M END