
 OpenBabel04291915333D

 26 26  0  0  0  0  0  0  0  0999 V2000
    9.0942   -0.6744   -4.7400 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4007   -0.5052   -3.5508 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0517   -0.5040   -3.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3802   -0.3402   -2.3995 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0373   -0.3391   -2.3997 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3658   -0.5018   -3.5512 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0229   -0.5007   -3.5514 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3802   -0.6668   -4.7025 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1022   -0.8429   -5.9406 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4884   -0.9917   -6.9932 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0403   -0.6664   -4.7079 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3468   -0.8345   -5.8972 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3863   -0.3391   -2.3997 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0798   -0.5072   -3.5890 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1462   -0.6478   -4.5463 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8364    0.1121   -5.4182 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8349   -1.6179   -5.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8962   -0.2152   -1.5146 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0052   -0.4758   -3.3819 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1342   -0.8438   -5.9404 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0422   -0.9492   -6.7024 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7324    0.0231   -6.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7309   -1.7069   -5.8308 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1318   -0.4798   -3.3954 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8213    0.2794   -4.2669 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8213   -1.4507   -4.0224 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  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  5  1  0  0  0  0
  4 18  1  0  0  0  0
  5 13  1  0  0  0  0
  5  6  2  0  0  0  0
  6 11  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 19  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 20  1  0  0  0  0
 11 12  1  0  0  0  0
 12 21  1  0  0  0  0
 12 22  1  0  0  0  0
 12 23  1  0  0  0  0
 13 14  1  0  0  0  0
 14 24  1  0  0  0  0
 14 25  1  0  0  0  0
 14 26  1  0  0  0  0
M  END
>  <SKU>
A10090

>  <Product Name>
Asaraldehyde (Asaronaldehyde)

>  <CAS>
4460-86-0

>  <M.Wt>
196.19988

>  <Formula>
C10H12O4

>  <Synonyms>
Asaronaldehyde, Asarylaldehyde, NSC 89299 

>  <URL>
https://www.adooq.com/asaraldehyde-asaronaldehyde.html

$$$$
