Mol:FL6F1ANS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 20 22  0  0  0  0  0  0  0  0999 V2000
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    0.8872    1.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3728    0.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1273    0.5342    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6292    0.1424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6292    0.6201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  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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 14 15  1  0  0  0  0
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  9 17  1  1  0  0  0
  1 18  1  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  19  20
M  SBL   1  1  21
M  SMT   1 OCH3
M  SBV   1 21   -6.7371    4.1099
S  SKP  8
ID	FL6F1ANS0001
KNApSAcK_ID	C00000943
NAME	Broussin
CAS_RN	76045-50-6
FORMULA	C16H16O3
EXACTMASS	256.109944378
AVERAGEMASS	256.29643999999996
SMILES	COc(c3)ccc(c3)C([H])(C1)Oc(c2)c(ccc(O)2)C1
M  END

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