Mol:FL7DBANS0001

Untitled ACS Document 1996-3 
  ChemDraw11301216092D 
 
 20 22  0  0  0  0  0  0  0  0999 V2000 
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   -1.0718   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3572    0.8250    0.0000 O   0  3  0  0  0  3  0  0  0  0  0  0 
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   -0.3572   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5007    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5007   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7862   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3572   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0718    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2152    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5007   -2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7862    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0718    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.5007    1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2152    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0 
  1  3  1  0 
  1  4  1  0 
  2  5  1  0 
  2  6  1  0 
  3  7  2  0 
  4  8  2  0 
  5  9  2  0 
  5 10  1  0 
  6 11  2  0 
  7 11  1  0 
  7 12  1  0 
  8  9  1  0 
  8 13  1  0 
 10 14  1  0 
 12 15  1  0 
 12 16  2  0 
 15 17  2  0 
 16 18  1  0 
 17 19  1  0 
 18 19  2  0 
 19 20  1  0 
M  CHG  1   3   1 
S  SKP  5 
ID	FL7DBANS0001 
FORMULA	C16H13O4 
EXACTMASS	269.081383904 
AVERAGEMASS	269.27202 
SMILES	COc(c3)c(c2)c(cc(O)3)[o+1]c(c2)c(c1)ccc(O)c1 
M  END