Mol:FL1C9ANS0001

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FL1C9ANS0001.png

 
 
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 18 19  0  0  0  0  0  0  0  0999 V2000 
   -2.2321    0.5678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2321   -0.0746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -1.1195    0.5678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6758    0.8890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5632   -0.3958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0069   -0.0746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5492   -0.3956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1053   -0.0746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6663   -0.3985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2273   -0.0746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2273    0.5732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6663    0.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.1053    0.5732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5632   -0.8971    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7882    0.8888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7882    0.8970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  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 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 10  1  0  0  0  0 
  7 16  2  0  0  0  0 
  1 17  1  0  0  0  0 
 13 18  1  0  0  0  0 
S  SKP  8 
ID	FL1C9ANS0001 
KNApSAcK_ID	C00006919 
NAME	4,4'-Dihydroxychalcone 
CAS_RN	3600-61-1 
FORMULA	C15H12O3 
EXACTMASS	240.07864425 
AVERAGEMASS	240.25398 
SMILES	Oc(c2)ccc(c2)C=CC(=O)c(c1)ccc(O)c1 
M  END
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