Mol:LBF16401SC01


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

18 17  0  0  0  0  0  0  0  0999 V2000 
   4.5042   -0.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2188   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.9333   -0.6180    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.2188    0.6195    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7895   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.0751   -0.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2501   -0.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.5356   -0.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.8211   -0.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.1091   -0.2070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7159   -0.2070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4303   -0.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.1423   -0.2084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.8543   -0.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6793   -0.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.3938   -0.2070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.1083   -0.6195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.9333   -0.6195    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 
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 7  8  1  0 
 8  9  1  0 
 9 10  1  0 
10 11  2  0 
11 12  1  0 
12 13  1  0 
13 14  1  0 
14 15  2  0 
15 16  1  0 
16 17  1  0 
17 18  2  0 

S SKP 6 ID LBF16401SC01 FORMULA C16H24O2 EXACTMASS 248.17763001199998 AVERAGEMASS 248.36056 SMILES C=CCC=CCCC=CCCC=CCCC(O)=O AUTODRAW FALSE M END