Mol:LBF20118BC01

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LBF20118BC01.png

 
 
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 24 23  0  0  1  0  0  0  0  0999 V2000 
    4.5981   -3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -4.5000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    3.7321   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5263    7.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7321   -6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5981   -6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4641   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.3301   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.1962    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0622    2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.9282    4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    4.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.7942    5.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    6.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6603    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -6.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8660   -7.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -6.0000    0.0000 O   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 
  3  5  2  0  0  0  0 
 22 23  1  0  0  0  0 
  5  6  1  0  0  0  0 
  2  7  1  4  0  0  0 
  1  8  1  0  0  0  0 
  4 21  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 
 14 15  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 
 18 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
  5 22  1  0  0  0  0 
 22 24  2  0  0  0  0 
S  SKP  5 
ID	LBF20118BC01 
FORMULA	C22H42O2 
EXACTMASS	338.318480588 
AVERAGEMASS	338.56768000000005 
SMILES	CC(=CC(CCCCCCCCCCCCCCCC)C)C(O)=O 
M  END
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