Mol:LBF16403SC01

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

18 17  0  0  0  0  0  0  0  0999 V2000 
   4.5054   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2201   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.9345   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2201    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7907   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.0763   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2513   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.5368   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.8224   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0026   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7171   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4291   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2541   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9686   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6830   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.5080   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.2225   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.9345   -0.6159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
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 2  4  2  0 
 1  5  1  0 
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 9 10  2  0 
10 11  1  0 
11 12  1  0 
12 13  2  0 
13 14  1  0 
14 15  1  0 
15 16  2  0 
16 17  1  0 
17 18  1  0 

S SKP 6 ID LBF16403SC01 FORMULA C16H24O2 EXACTMASS 248.17763001199998 AVERAGEMASS 248.36056 SMILES CCC=CCC=CCC=CCC=CCCC(O)=O AUTODRAW FALSE M END