HMDB0031496
     RDKit          3D
2-Hexenal
 17 16  0  0  0  0  0  0  0  0999 V2000
   -2.6333    0.7353   -0.1274 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4021   -0.1224   -0.3353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2612    0.4165    0.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9079   -0.4794    0.2633 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0557   -0.0154   -0.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1891   -0.8905   -0.4906 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1786   -2.1211   -0.2631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4880    0.0617    0.1754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4323    1.4789    0.6406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9410    1.1576   -1.1088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5759   -1.1731   -0.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0336   -0.0252   -1.3946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0658    1.4424    0.1502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5217    0.4877    1.5796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8633   -1.5376    0.4717 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0705    1.0469   -0.4365 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0898   -0.4626   -0.8955 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
  5  6  1  0
  6  7  2  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  4 15  1  0
  5 16  1  0
  6 17  1  0
M  END