Mol:LBF09103BC01

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

13 12  0  0  0  0  0  0  0  0999 V2000 
   1.8402   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.5549    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.2693   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   2.5549    1.0312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   1.1255    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.4111   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.3034    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.0178   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8428   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.5573    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.8428   -1.0312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.8402   -1.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.2693   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 2  4  2  0 
 1  5  1  0 
 5  6  1  0 
 6  7  1  0 
 7  8  1  0 
 8  9  2  0 
 9 10  1  0 
 9 11  1  0 
 1 12  1  0 
10 13  1  0

S SKP 6 ID LBF09103BC01 FORMULA C11H20O2 EXACTMASS 184.14632988399998 AVERAGEMASS 184.2753 SMILES CCC(C)=CCCCC(C)C(O)=O AUTODRAW FALSE M END

Mol:LBF09103BC01

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