Mol:LBF18306SC02

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

20 19  0  0  0  0  0  0  0  0999 V2000 
   5.1609   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.8755   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   6.5900   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.8755    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.4462   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.7318   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.0173   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.3028   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.4778   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.7634   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.0514   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7736   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4881   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2026   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.0276   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.7420   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.4540   -0.6159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.1660   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.8780   -0.6159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.5900   -0.2048    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  2  0 
 9 10  1  0 
10 11  1  0 
11 12  2  0 
12 13  1  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 LBF18306SC02 FORMULA C18H30O2 EXACTMASS 278.224580204 AVERAGEMASS 278.4296 SMILES CCCCCC=CCC=CCC=CCCCCC(O)=O AUTODRAW FALSE M END

Mol:LBF18306SC02

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