Mol:PR100868

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PR100868.png

 
  ACD/Labs11130911112D 
 
 14 15  0  0  0  0  0  0  0  0  1 V2000 
   11.8239  -10.1032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.8239  -11.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6720   -9.4382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6720  -12.0982    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    9.5202  -10.1032    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    9.5202  -11.4332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.0888   -9.6922    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
   13.8705  -10.7682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.0889  -11.8442    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    8.3684   -9.4382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.3684  -12.0982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6719  -13.4282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   15.2005  -10.7681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6720   -8.1082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  3  1  1  0  0  0  0 
  4  2  1  0  0  0  0 
  5  3  1  0  0  0  0 
  6  4  1  0  0  0  0 
  6  5  1  0  0  0  0 
  7  1  1  0  0  0  0 
  2  1  2  0  0  0  0 
  8  7  1  0  0  0  0 
  9  2  1  0  0  0  0 
  9  8  1  0  0  0  0 
  5 10  1  0  0  0  0 
  6 11  2  0  0  0  0 
  4 12  1  0  0  0  0 
  8 13  2  0  0  0  0 
  3 14  2  0  0  0  0 
S  SKP  7 
CAS_RN	944-73-0 
NAME	1,3-Dimethylurate 
ID	PR100868 
FORMULA	C7H8N4O3 
EXACTMASS	196.059640142 
AVERAGEMASS	196.16358 
SMILES	O=C(N1)NC(N(C)2)=C1C(=O)N(C)C(=O)2 
M  END
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