Mol:LBF18206SC02

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

20 19  0  0  0  0  0  0  0  0999 V2000 
   5.0442   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7588   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   6.4733   -0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   5.7588    0.6187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   4.3295   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   3.6151   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.9006   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   2.0756   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   1.3611   -0.6187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   0.6466   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.0654   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -0.7773   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -1.4893   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.2013   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -2.9133   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -3.6253   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -4.3373   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.0493   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -5.7613   -0.6173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  -6.4733   -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  2  0 
 8  9  1  0 
 9 10  1  0 
10 11  1  0 
11 12  1  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 LBF18206SC02 FORMULA C18H32O2 EXACTMASS 280.240230268 AVERAGEMASS 280.44548000000003 SMILES CCCCCC=CCCCCCC=CCCCC(O)=O AUTODRAW FALSE M END

Mol:LBF18206SC02

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