Mol:LBF26109SC01


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

28 27  0  0  0  0  0  0  0  0999 V2000 
   2.1360    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.8506    0.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.5651    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.4213    0.4148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7069    0.0023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0051    0.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.2771    0.4133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   4.9891    0.0022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.2771    1.2355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7171    0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  -2.1411    0.0022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.8531    0.4132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.5651    0.0021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  -4.9891    0.0020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.9891   -0.8230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  -2.0206   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.3087   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.5967   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.1153   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.8273   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.5393   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.2513   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9633   -0.8244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 1  4  1  0 
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26 27  1  0 
27 28  1  0 

S SKP 6 ID LBF26109SC01 FORMULA C26H50O2 EXACTMASS 394.381080844 AVERAGEMASS 394.674 SMILES OC(=O)CCCCCCCCCCCCCCCC=CCCCCCCCC AUTODRAW FALSE M END