Mol:LBF16401SC02

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LBF16401SC02.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 18 17  0  0  0  0  0  0  0  0999 V2000
    3.6011   -0.7253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1594    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6544   -0.6236    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1594    0.7253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9961    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3911   -0.6153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8136    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1536   -0.6772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5486    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0289   -0.6153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5789    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1289   -0.6153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7339    0.1656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3939   -0.6153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9439    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5214   -0.6153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0714    0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6544   -0.4558    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
  1  5  1  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
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
S  SKP  5
ID	LBF16401SC02
FORMULA	C16H24O2
EXACTMASS	248.17763001199998
AVERAGEMASS	248.36056
SMILES	C=CCC=CCC=CCC=CCCCCC(O)=O
M  END

</pre>

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