Mol:LBF16000HO03

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LBF16000HO03.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 19 18  0  0  1  0  0  0  0  0999 V2000
    3.0949   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6778   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3049   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8920   -0.6062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3103    0.6601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5119   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9289   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3458   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7628   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1799   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4031   -0.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9861   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5967   -0.0246    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.3450   -0.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9284   -0.2171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5118   -0.8004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0951   -0.2171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8920   -0.4306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5967    0.8004    0.0000 O   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
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  1  6  1  0  0  0  0
  6  7  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
 10 11  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
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 13 19  1  4  0  0  0
S  SKP  5
ID	LBF16000HO03
FORMULA	C16H32O3
EXACTMASS	272.23514489
AVERAGEMASS	272.42348
SMILES	CCCCCC(O)CCCCCCCCCC(O)=O
M  END

</pre>

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