Mol:LBF17115SC01

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LBF17115SC01.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 19 18  0  0  0  0  0  0  0  0999 V2000 
    4.1745   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7877   -0.1918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5027   -0.6029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7877    0.6359    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5695   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9370   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2852   -0.1189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6225   -0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9859   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3520   -0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2255   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8979   -0.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5455   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2151   -0.6071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8655   -0.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5351   -0.5768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.1827   -0.0681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.8524   -0.5479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.5027   -0.0378    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 
  5  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  1  5  2  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 
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 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
 18 19  1  0  0  0  0 
S  SKP  5 
ID	LBF17115SC01 
FORMULA	C17H32O2 
EXACTMASS	268.240230268 
AVERAGEMASS	268.43478 
SMILES	CCCCCCCCCCCCCCC=CC(O)=O 
M  END
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