Mol:FL1C3CNS0003

<pre>

Copyright: ARM project http://www.metabolome.jp/
 25 26  0  0  0  0  0  0  0  0999 V2000
   -3.2643    0.1937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7722   -0.2192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1685    0.0005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0570    0.6331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5491    1.0460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1527    0.8263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4534    0.8528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3418    1.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6269    2.3374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0182    2.5589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0943    3.1969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.0107    3.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0340    3.5389    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9737    3.8809    0.0000 C   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
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 15 10  1  0  0  0  0
  7 16  2  0  0  0  0
  3 17  1  0  0  0  0
 13 18  1  0  0  0  0
 18 19  1  0  0  0  0
  1 20  1  0  0  0  0
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  2 22  1  0  0  0  0
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 12 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  STY  1   4 SUP
M  SLB  1   4   4
M  SAL   4  2  24  25
M  SBL   4  1  25
M  SMT   4  OCH3
M  SVB   4 25    2.1529   -0.3552
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  22  23
M  SBL   3  1  23
M  SMT   3  OCH3
M  SVB   3 23   -3.2246   -0.0575
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  20  21
M  SBL   2  1  21
M  SMT   2  OCH3
M  SVB   2 21   -2.8674    1.1122
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  18  19
M  SBL   1  1  19
M  SMT   1  OCH3
M  SVB   1 19    2.5101    0.8227
S  SKP  8
ID	FL1C3CNS0003
KNApSAcK_ID	C00006971
NAME	Okanin 3,4,3',4'-tetramethyl ether
CAS_RN	94285-19-5
FORMULA	C19H20O6
EXACTMASS	344.125988372
AVERAGEMASS	344.3585
SMILES	c(c1O)(OC)c(OC)ccc1C(=O)C=Cc(c2)cc(OC)c(OC)c2
M  END

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