Mol:LBF18306SC04

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

20 19  0  0  0  0  0  0  0  0999 V2000 
   5.0466   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7613   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   6.4757   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7613    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.3320   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.6175   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9031   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.1886   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.4766   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7646   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.0526   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.6594   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.3714   -0.2077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.0834   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9084   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6228   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.3373   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.0518   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.7638   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.4757   -0.2062    0.0000 C   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  1  0 
 7  8  1  0 
 8  9  1  0 
 9 10  1  0 
10 11  2  0 
11 12  1  0 
12 13  2  0 
13 14  1  0 
14 15  2  0 
15 16  1  0 
16 17  1  0 
17 18  1  0 
18 19  1  0 
19 20  1  0 

S SKP 6 ID LBF18306SC04 FORMULA C18H30O2 EXACTMASS 278.224580204 AVERAGEMASS 278.4296 SMILES CCCCCC=CC=CC=CCCCCCCC(O)=O AUTODRAW FALSE M END