Mol:LBF11000BC07

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LBF11000BC07.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 14 13  0  0  1  0  0  0  0  0999 V2000
   -4.2058    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1096    0.2181    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1096    1.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7947    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2058    0.9301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2058   -0.4939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5936    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1825   -0.4939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3604   -0.4939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9493   -1.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3545    0.2181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7655   -0.4939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5877   -0.4939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9987   -1.2059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  4  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  2 11  1  0  0  0  0
  4 14  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
S  SKP  5
ID	LBF11000BC07
FORMULA	C12H24O2
EXACTMASS	200.17763001199998
AVERAGEMASS	200.31776
SMILES	CCCCCC(C)CCCCC(O)=O
M  END

</pre>

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