Mol:LBF16114SC01

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 18 17  0  0  0  0  0  0  0  0999 V2000 
    3.8493   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4626   -0.1918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1776   -0.6029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4626    0.6359    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2443   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6118   -0.6222    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9601   -0.1189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2973   -0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6607   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0268   -0.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5507   -0.1547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2231   -0.6359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8707   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5403   -0.6071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1907   -0.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.8603   -0.5768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.5079   -0.0681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.1776   -0.5479    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 
 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 
S  SKP  5 
ID	LBF16114SC01 
FORMULA	C16H30O2 
EXACTMASS	254.22458020399998 
AVERAGEMASS	254.4082 
SMILES	CCCCCCCCCCCCCC=CC(O)=O 
M  END