Mol:LBF18208HP01

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LBF18208HP01.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 27 26  0  0  1  0  0  0  0  0999 V2000 
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    1.4740   -1.2183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.4740   -2.6472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0614   -3.3618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5852    1.2993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2997    1.7118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2997    2.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4747    2.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2997    3.3618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1247    2.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -0.2856   -0.5039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8290    0.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2414    0.2106    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2414    1.6395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8290    2.3539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1390    0.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2841    0.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
 26 27  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  1  0  0  0  0 
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  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
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  4 12  1  4  0  0  0 
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  1 18  1  0  0  0  0 
  2 21  1  0  0  0  0 
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 22 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
  2 26  2  0  0  0  0 
  3 27  2  0  0  0  0 
S  SKP  5 
ID	LBF18208HP01 
FORMULA	C23H42O4 
EXACTMASS	382.30830983199996 
AVERAGEMASS	382.57718 
SMILES	C(CCCC(=O)OC)CCCC(OOC(C)(C)C)C=CC=CCCCCC 
M  END
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