Mol:LBF22000SC01

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LBF22000SC01.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 24 23  0  0  0  0  0  0  0  0999 V2000
    3.9497    0.6538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6647    0.2427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9497    1.4816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3364    0.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6489    0.6909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9876    0.1973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3193    0.6786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6593    0.1863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3427    0.6566    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0027    0.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.3364    0.1533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0047    0.6346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6647    0.1423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6647   -1.0141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9511   -1.4816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3364   -1.0141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6476   -1.4664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9903   -0.9659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3014   -1.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6442   -0.9178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0447   -1.3702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  4  1  1  0  0  0  0
  4  5  1  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
  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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
S  SKP  5
ID	LBF22000SC01
FORMULA	C22H44O2
EXACTMASS	340.334130652
AVERAGEMASS	340.58356000000003
SMILES	C(CCC(O)=O)CCCCCCCCCCCCCCCCCC
M  END

</pre>

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