Mol:LBPR01040039

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LBPR01040039.png

 
 
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 23 23  0  0  0  0  0  0  0  0999 V2000 
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   -0.3567    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.0713    0.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7859   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.5005    1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2150   -0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2150   -1.0313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.9297   -1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5005   -1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0713    1.4438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  1  6  1  0  0  0  0 
  6  7  1  0  0  0  0 
  6  8  1  0  0  0  0 
  5  9  1  0  0  0  0 
  4 10  1  0  0  0  0 
  9 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  0  0  0  0 
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 17 19  2  0  0  0  0 
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 20 21  2  0  0  0  0 
 20 22  1  0  0  0  0 
 13 23  2  0  0  0  0 
S  SKP  5 
ID	LBPR01040039 
FORMULA	C20H26O3 
EXACTMASS	314.18819469799996 
AVERAGEMASS	314.41864 
SMILES	C(C1(C)C)(C=CC(C=O)=CC=CC(C)=CC(O)=O)=C(C)CCC1 
M  END
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