Mol:LBF14105SC01

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LBF14105SC01.png

 
 
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 16 15  0  0  0  0  0  0  0  0999 V2000 
    3.0910   -0.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7042   -0.1196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4192   -0.5307    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7042    0.7081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4860   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8535   -0.5500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2017   -0.0467    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5390   -0.5363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0976   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7315   -0.5363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3090   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1065   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6015   -0.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2615   -0.0825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.7977   -0.7081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.4192   -0.1636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  1  5  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
S  SKP  5 
ID	LBF14105SC01 
FORMULA	C14H26O2 
EXACTMASS	226.19328007599998 
AVERAGEMASS	226.35504 
SMILES	CCCCC=CCCCCCCCC(O)=O 
M  END
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