
 OpenBabel04291915423D

 29 31  0  0  0  0  0  0  0  0999 V2000
   13.7436    4.1503   -1.5148 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6574    3.3254   -1.2149 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8593    2.1193   -0.7776 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8491    1.3521   -0.4986 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0510    0.1460   -0.0614 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0409   -0.6212    0.2176 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2427   -1.8273    0.6549 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.5959    1.8061   -0.6623 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3872    3.0532   -1.1145 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1282    3.5092   -1.2789 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9127    4.7973   -1.7458 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4556    5.0522   -1.8372 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0080    6.2426   -2.2686 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6877    6.4736   -2.3514 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2400    7.6640   -2.7827 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9197    7.8950   -2.8655 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5829    4.0929   -1.4886 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4454    3.7644   -1.3732 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6623    3.8176   -1.3948 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.5905    5.0646   -1.8463 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0778   -0.2723    0.0918 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3549    4.9043   -2.7143 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3561    5.5000   -1.0717 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6786    6.9799   -2.5364 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0170    5.7364   -2.0835 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9107    8.4012   -3.0506 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0599    8.4318   -3.0596 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5185    3.1246   -1.1375 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3210    4.6826   -1.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  2  3  2  0  0  0  0
  2 18  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 21  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
  9 18  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 22  1  0  0  0  0
 11 23  1  0  0  0  0
 12 13  2  0  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 13 24  1  0  0  0  0
 14 15  2  0  0  0  0
 14 25  1  0  0  0  0
 15 16  1  0  0  0  0
 15 26  1  0  0  0  0
 16 17  2  0  0  0  0
 16 27  1  0  0  0  0
 17 28  1  0  0  0  0
 18 29  1  0  0  0  0
M  END
>  <SKU>
A13706

>  <Product Name>
O6-Benzylguanine

>  <CAS>
19916-73-5

>  <M.Wt>
241.24864

>  <Formula>
C12H11N5O

>  <Synonyms>
CCRIS 9383

>  <URL>
https://www.adooq.com/o6-benzylguanine.html

$$$$
