
 OpenBabel04291915423D

 32 31  0  0  0  0  0  0  0  0999 V2000
    0.9658    0.0926    0.0161 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4858    0.0926    0.0161 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9924    1.5045    0.2613 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4744    1.5045    0.2613 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1314    2.6257    0.4561 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6134    2.6257    0.4561 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1074    4.0023    0.6952 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3994    4.2389    0.7362 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8807    5.5803    0.9692 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1726    5.8168    1.0103 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6539    7.1582    1.2433 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9033    7.3870    1.2830 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3530    8.6401    1.5007 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.6793    8.8829    1.5429 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0741    9.9831    1.7339 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6091   -0.9014   -0.1566 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6091    0.7390   -0.7584 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6091    0.4400    0.9632 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8424   -0.2549   -0.9310 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8424   -0.5539    0.7905 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6358    1.8520    1.2084 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6358    2.1510   -0.5131 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9904    0.6240    0.1084 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6154    3.5063    0.6090 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9701    2.2783   -0.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9701    1.9792    1.2305 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4368    4.7752    0.8294 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0700    3.4661    0.6020 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2101    6.3531    1.1035 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8432    5.0440    0.8761 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9833    7.9310    1.3775 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7132    9.3773    1.6287 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  3  4  1  0  0  0  0
  3 21  1  0  0  0  0
  3 22  1  0  0  0  0
  4  5  2  0  0  0  0
  4 23  1  0  0  0  0
  5  6  1  0  0  0  0
  5 24  1  0  0  0  0
  6  7  1  0  0  0  0
  6 25  1  0  0  0  0
  6 26  1  0  0  0  0
  7  8  2  0  0  0  0
  7 27  1  0  0  0  0
  8  9  1  0  0  0  0
  8 28  1  0  0  0  0
  9 10  2  0  0  0  0
  9 29  1  0  0  0  0
 10 11  1  0  0  0  0
 10 30  1  0  0  0  0
 11 12  2  0  0  0  0
 11 31  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 32  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
>  <SKU>
A13999

>  <Product Name>
Triacsin C

>  <CAS>
76896-80-5

>  <M.Wt>
207.27218

>  <Formula>
C11H17N3O

>  <Synonyms>
WS1228A, FR 900190

>  <URL>
https://www.adooq.com/triacsin-c.html

$$$$
