KEGG   COMPOUND: C19147
Entry
C19147                      Compound                               
Name
Piperonyl sulfoxide
Formula
C18H28O3S
Exact mass
324.1759
Mol weight
324.48
Structure
Brite
Pesticides [BR:br08007]
 Obsolete pesticides
  Others
   Synergists
    C19147  Piperonyl sulfoxide
Other DBs
CAS: 120-62-7
PubChem: 124489819
KNApSAcK: C00049313
LinkDB
KCF data

ATOM        22
            1   C8y C    20.9977  -19.4068
            2   C8y C    20.9977  -18.0010
            3   C8x C    22.1926  -17.2981
            4   C8y C    23.4579  -18.0010
            5   C8x C    23.4579  -19.4068
            6   C8x C    22.1926  -20.1097
            7   O2x O    19.6622  -19.8286
            8   C1x C    18.8188  -18.7039
            9   O2x O    19.6622  -17.5793
            10  C1b C    24.6528  -17.2981
            11  C1c C    25.9180  -18.0010
            12  S4a S    27.1129  -17.2981
            13  C1a C    25.9180  -19.4068
            14  C1b C    28.3078  -18.0010
            15  O3c O    27.1129  -15.8924
            16  C1b C    29.5027  -17.2981
            17  C1b C    30.6977  -18.0010
            18  C1b C    31.8926  -17.2981
            19  C1b C    33.0875  -18.0010
            20  C1b C    34.2824  -17.2981
            21  C1b C    35.4773  -18.0010
            22  C1a C    36.6723  -17.2981
BOND        23
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 1
            10    2   9 1
            11    4  10 1
            12   10  11 1
            13   11  12 1
            14   11  13 1
            15   12  14 1
            16   12  15 2
            17   14  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1

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