Mol:LBF10108SC01

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

12 11  0  0  0  0  0  0  0  0999 V2000 
   2.1924   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9070   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.6215   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9070    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.3674   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.6529   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0615   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7735   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4855   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.1975   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9095   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6215   -0.2077    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  2  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 
11 12  1  0 

S SKP 6 ID LBF10108SC01 FORMULA C10H18O2 EXACTMASS 170.13067981999998 AVERAGEMASS 170.24872 SMILES CCCCCCCC=CC(O)=O AUTODRAW FALSE M END