
 OpenBabel04291915413D

 50 53  0  0  0  0  0  0  0  0999 V2000
   23.5038   -6.0002   -8.5212 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7873   -5.3170   -7.5498 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.4391   -4.6403   -6.5818 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7453   -3.9788   -5.6413 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3942   -3.3042   -4.6783 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7368   -3.2912   -4.6558 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4306   -3.9527   -5.5963 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7902   -5.3148   -7.5448 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6655   -2.3258   -3.2776 Br  0  0  0  0  0  0  0  0  0  0  0  0
   21.3491   -3.9924   -5.6648 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.6276   -3.3045   -4.6867 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2207   -2.6879   -3.8064 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2314   -3.3181   -4.7102 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.5099   -2.6302   -3.7321 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1672   -2.6432   -3.7547 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4734   -1.9817   -2.8142 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1308   -1.9948   -2.8367 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4370   -1.3333   -1.8962 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5558   -3.3343   -4.7528 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2047   -2.6598   -3.7898 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5109   -1.9983   -2.8493 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1385   -1.3459   -1.9180 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3974   -0.6393   -0.9134 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9458   -0.8090   -1.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0536   -0.2312   -0.3387 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7383   -0.3850   -0.5617 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3291   -1.0925   -1.5710 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1920   -1.6513   -2.3647 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5227   -1.5406   -2.2030 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8105    0.2159    0.2917 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.8243   -6.4733   -9.1990 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.1178   -6.7425   -8.0555 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.1222   -5.3118   -9.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.8610   -2.7959   -3.9556 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.4514   -4.0412   -5.7194 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.1485   -5.7783   -8.2070 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8734   -4.4869   -6.3707 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.7557   -3.8126   -5.4161 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.6686   -3.1616   -4.4947 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.9721   -1.4634   -2.0741 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.6321   -2.5132   -3.5767 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.2365   -2.6497   -3.7725 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4791   -2.0083   -2.8666 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6464    0.4006   -0.9517 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6435   -1.0296    0.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3788    0.3310    0.4633 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8391   -2.2080   -3.1588 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1861   -1.9957   -2.8494 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1206    0.7522    1.0568 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8462    0.1031    0.1283 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 31  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4 10  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 34  1  0  0  0  0
  6  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 35  1  0  0  0  0
  8 36  1  0  0  0  0
 10 11  1  0  0  0  0
 10 37  1  0  0  0  0
 11 13  1  0  0  0  0
 11 12  2  0  0  0  0
 13 14  1  0  0  0  0
 13 38  1  0  0  0  0
 14 15  2  0  0  0  0
 14 19  1  0  0  0  0
 15 16  1  0  0  0  0
 15 39  1  0  0  0  0
 16 17  2  0  0  0  0
 16 40  1  0  0  0  0
 17 18  1  0  0  0  0
 17 41  1  0  0  0  0
 18 22  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 42  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 44  1  0  0  0  0
 23 45  1  0  0  0  0
 24 25  2  0  0  0  0
 24 29  1  0  0  0  0
 25 26  1  0  0  0  0
 25 46  1  0  0  0  0
 26 30  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 28 47  1  0  0  0  0
 29 48  1  0  0  0  0
 30 49  1  0  0  0  0
 30 50  1  0  0  0  0
M  END
>  <SKU>
A13545

>  <Product Name>
JI-101

>  <CAS>
900573-88-8

>  <M.Wt>
466.3305

>  <Formula>
C22H20BrN5O2

>  <Synonyms>
JI 101, JI101

>  <URL>
https://www.adooq.com/ji-101.html

$$$$
