
 OpenBabel04291915473D

 28 31  0  0  0  0  0  0  0  0999 V2000
   12.9617   -6.5694    6.9915 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3109   -7.3419    7.8122 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0401   -7.3419    7.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3181   -6.4857    6.9008 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9752   -6.4857    6.9008 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2532   -7.3419    7.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9025   -8.1119    8.6320 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2532   -8.8820    9.4518 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9246   -9.6783   10.2994 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2532  -10.4746   11.1471 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9246  -11.2709   11.9947 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2532  -12.0671   12.8424 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9103   -8.8820    9.4518 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2609   -8.1119    8.6320 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3181   -8.1981    8.7237 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3037   -5.6894    6.0531 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9608   -5.6894    6.0531 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2893   -4.8931    5.2054 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9896   -5.6894    6.0531 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8987   -6.5694    6.9915 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9566   -9.6783   10.2994 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2212  -10.4746   11.1471 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9566  -11.2709   11.9947 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1283  -12.7685   13.5891 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8197   -5.0775    5.4017 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4448   -6.3013    6.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4646   -4.4684    4.7533 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9392   -5.4127    5.7586 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4 19  1  0  0  0  0
  5 16  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 13  1  0  0  0  0
  9 10  1  0  0  0  0
  9 21  1  0  0  0  0
 10 11  2  0  0  0  0
 10 22  1  0  0  0  0
 11 12  1  0  0  0  0
 11 23  1  0  0  0  0
 12 13  2  0  0  0  0
 12 24  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 16 17  2  0  0  0  0
 16 25  1  0  0  0  0
 17 18  1  0  0  0  0
 17 26  1  0  0  0  0
 18 19  2  0  0  0  0
 18 27  1  0  0  0  0
 19 28  1  0  0  0  0
M  END
>  <SKU>
A16062

>  <Product Name>
IQ-1S

>  <CAS>
23146-22-7

>  <M.Wt>
247.25146

>  <Formula>
C15H9N3O

>  <Synonyms>
IQ1S

>  <URL>
https://www.adooq.com/iq-1s.html

$$$$
