Mol:LBF14112SC01

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LBF14112SC01.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 16 15  0  0  0  0  0  0  0  0999 V2000 
    3.2787   -0.5658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8919   -0.1354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.6069   -0.5466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8919    0.6923    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6737   -0.0983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0412   -0.5658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3894   -0.0626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7267   -0.5521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0901   -0.0983    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5438   -0.5521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2011   -0.1354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8734   -0.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5719   -0.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2416   -0.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.9373   -0.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.6069   -0.6923    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  2  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 11 12  1  0  0  0  0 
 10 11  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 
S  SKP  5 
ID	LBF14112SC01 
FORMULA	C14H26O2 
EXACTMASS	226.19328007599998 
AVERAGEMASS	226.35504 
SMILES	CCCCCCCCCCCC=CC(O)=O 
M  END
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