HMDB0032403
     RDKit          3D
6-Methyl-3-hepten-2-one, trans-
 23 22  0  0  0  0  0  0  0  0999 V2000
   -3.6193    0.3671    0.7400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5394   -0.4457    1.3231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7505   -1.1798    2.3180 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1708   -0.4494    0.7878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8329    0.2843   -0.2566 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4830    0.3673   -0.8773 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5625   -0.4494   -0.2554 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8246   -0.1970   -1.1029 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8951    0.0445    1.1436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6211    0.3438   -0.3808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5369    1.4389    1.0122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5891   -0.0720    1.0606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3974   -1.0594    1.2293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6639    0.8808   -0.6705 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8097    1.4407   -0.8291 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4629    0.1430   -1.9800 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3893   -1.5225   -0.2639 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8091    0.8807   -1.3393 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8718   -0.8576   -1.9694 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7234   -0.4240   -0.4581 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8960   -0.8407    1.8177 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1055    0.7624    1.4464 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8883    0.5441    1.1236 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  4 13  1  0
  5 14  1  0
  6 15  1  0
  6 16  1  0
  7 17  1  0
  8 18  1  0
  8 19  1  0
  8 20  1  0
  9 21  1  0
  9 22  1  0
  9 23  1  0
M  END