Mol:LBF16306HO01

Copyright: ARM project http://www.metabolome.jp/

19 18  0  0  0  0  0  0  0  0999 V2000 
   4.3874   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.1021   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.8165   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.1021    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   3.6728   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9583   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.1333   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.4189   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7069   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0051   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7171   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4291   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2541   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9686   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6806   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.3926   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.1045   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.8165   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0051    0.6159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 1  2  1  0 
 2  3  1  0 
 2  4  2  0 
 1  5  1  0 
 5  6  1  0 
 6  7  2  0 
 7  8  1  0 
 8  9  2  0 
 9 10  1  0 
10 11  1  0 
11 12  1  0 
12 13  2  0 
13 14  1  0 
14 15  1  0 
15 16  1  0 
16 17  1  0 
17 18  1  0 
10 19  1  1 

S SKP 6 ID LBF16306HO01 FORMULA C16H26O3 EXACTMASS 266.18819469799996 AVERAGEMASS 266.37584 SMILES CCCCCC=CCC(O)C=CC=CCCC(O)=O AUTODRAW FALSE M END