Mol:LBF14000BC08

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LBF14000BC08.png

 
 
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 18 17  0  0  1  0  0  0  0  0999 V2000 
   -1.6537    1.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4940    1.7846    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
   -1.2078    0.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4940    1.3874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8097    1.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2219    2.4985    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2219    1.0708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3292    1.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9170    1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3292    0.3569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9170   -0.3569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3292   -1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9170   -1.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.3292   -2.4985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0051    1.7846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4172    1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2415    1.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6537    0.3569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  2  4  1  0  0  0  0 
  3  4  1  0  0  0  0 
  5  6  2  0  0  0  0 
  5  7  1  0  0  0  0 
  1  8  1  0  0  0  0 
  2 14  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  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
  2 15  1  4  0  0  0 
  5 18  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
S  SKP  5 
ID	LBF14000BC08 
FORMULA	C16H32O2 
EXACTMASS	256.240230268 
AVERAGEMASS	256.42408 
SMILES	CCCCCCCCC(CC)CCCCC(O)=O 
M  END
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