Mol:LBF20306EO01

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LBF20306EO01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 23 23  0  0  1  0  0  0  0  0999 V2000
   -3.5289   -0.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1017   -0.1093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4517    1.0168    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8140    0.3018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8140    1.1268    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5284   -0.1107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  4  5  2  0  0  0  0
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  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
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 19 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
S  SKP  5
ID	LBF20306EO01
FORMULA	C20H32O3
EXACTMASS	320.23514489
AVERAGEMASS	320.46628
SMILES	C(CC=CCC=CCC=CCC(O1)C1CCCC(O)=O)CCC
M  END

</pre>

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