Mol:LBF16402SC01


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

18 17  0  0  0  0  0  0  0  0999 V2000 
   4.5066   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2213   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.9358   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2213    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7920   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.0775   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2525   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.5381   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.8261   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.0011   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7134   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  -2.1423   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9673   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6818   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.3963   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.2213   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.9358   -0.6173    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 
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10 11  1  0 
11 12  1  0 
12 13  1  0 
13 14  2  0 
14 15  1  0 
15 16  1  0 
16 17  2  0 
17 18  1  0 

S SKP 6 ID LBF16402SC01 FORMULA C16H24O2 EXACTMASS 248.17763001199998 AVERAGEMASS 248.36056 SMILES CC=CCC=CCC=CCCC=CCCC(O)=O AUTODRAW FALSE M END