
 OpenBabel04291915473D

 29 30  0  0  0  0  0  0  0  0999 V2000
   11.1833   -0.1531    0.9527 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5695    0.0233   -0.0957 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2915    0.2332   -1.3285 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6345    0.2354   -1.3281 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3059    0.4306   -2.4746 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6488    0.4328   -2.4742 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3233    0.2390   -1.3222 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6298    0.0374   -0.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3203    0.6280   -3.6207 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6201    0.4261   -2.4754 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2711    0.4239   -2.4757 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1255    0.0209   -0.0961 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4541    0.2139   -1.2430 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1112    0.2117   -1.2433 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4397    0.4046   -2.3902 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0968    0.4024   -2.3906 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4541   -0.1743    1.0504 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1505    0.0871   -0.4468 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7899    0.5789   -3.3560 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3252   -0.0972    0.6641 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0161   -0.8345   -0.2281 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0132    0.8883    0.0635 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1450    0.7329   -4.2322 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8026    0.2877   -1.6758 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9701    0.3639   -2.1240 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5952    0.0617   -0.3623 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9557    0.5546   -3.2713 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1472    0.4683   -2.7893 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5789   -0.3450    2.0605 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2 12  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  2  0  0  0  0
  5 19  1  0  0  0  0
  6  9  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8 20  1  0  0  0  0
  8 21  1  0  0  0  0
  8 22  1  0  0  0  0
  9 10  2  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 11 24  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 25  1  0  0  0  0
 14 15  2  0  0  0  0
 14 26  1  0  0  0  0
 15 16  1  0  0  0  0
 15 27  1  0  0  0  0
 16 17  2  0  0  0  0
 16 28  1  0  0  0  0
 17 29  1  0  0  0  0
M  END
>  <SKU>
A16141

>  <Product Name>
Oxybenzone

>  <CAS>
131-57-7

>  <M.Wt>
228.24328

>  <Formula>
C14H12O3

>  <Synonyms>
Eusolex 4360, Escalol 567

>  <URL>
https://www.adooq.com/oxybenzone.html

$$$$
