Mol:FL1A99NSH001

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FL1A99NSH001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 18 20  0  0  0  0  0  0  0  0999 V2000
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   -1.4300   -0.6655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7156   -1.9030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7156   -1.0780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0014   -0.6640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -1.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7141   -1.9032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2975   -2.4866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4295   -0.6667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4295    0.1579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1445    0.5707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1443    1.3958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4296    1.8079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7154    1.3953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7156    0.5703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4296    2.4866    0.0000 Cl  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  5  2  0  0  0  0
  6  4  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  2  0  0  0  0
  8 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 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
 15 18  1  0  0  0  0
S  SKP  8
ID	FL1A99NSH001
KNApSAcK_ID	C00014661
NAME	4'-Chloroaurone
CAS_RN	38216-61-4
FORMULA	C15H9ClO2
EXACTMASS	256.029107242
AVERAGEMASS	256.68346
SMILES	Clc(c3)ccc(c3)C=c(o1)c(=O)c(c2)c(ccc2)1
M  END

</pre>

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