HMDB0033889
     RDKit          3D
Ethyl butyrate
 20 19  0  0  0  0  0  0  0  0999 V2000
   -3.4569    0.0578   -0.1323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0128    0.3387   -0.5293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0602   -0.2297    0.5147 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3173    0.0719    0.0779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7572    1.2460    0.2536 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1733   -0.8255   -0.5109 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4881   -0.4281   -0.8958 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3011    0.0547    0.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1543    0.7733   -0.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6654   -1.0019   -0.3928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5472    0.1706    0.9860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9066    1.4184   -0.6598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7965   -0.1585   -1.5147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2239    0.2804    1.4748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2771   -1.2887    0.6440 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4687    0.3675   -1.6627 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9610   -1.3412   -1.3295 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3845   -0.0275    0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1631   -0.5975    1.1534 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0866    1.1193    0.4632 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  8 20  1  0
M  END