KEGG   COMPOUND: C10965
Entry
C10965                      Compound                               
Name
Bentazone
Formula
C10H12N2O3S
Exact mass
240.0569
Mol weight
240.2789
Structure
Other DBs
CAS: 25057-89-0
PubChem: 13148
ChEBI: 3018
NIKKAJI: J1.875I
KCF data

ATOM        16
            1   N4x N    28.0185  -21.2265
            2   S2x S    29.2029  -20.5351
            3   N4y N    29.2029  -19.1594
            4   C8y C    28.0185  -18.4680
            5   C8y C    26.8270  -20.5351
            6   C8y C    26.8270  -19.1594
            7   C8x C    25.6314  -18.4680
            8   C8x C    24.4427  -19.1594
            9   C8x C    24.4427  -20.5351
            10  C8x C    25.6314  -21.2265
            11  O5x O    28.0202  -17.0923
            12  C1c C    30.3990  -18.4689
            13  C1a C    31.5871  -19.1612
            14  C1a C    30.4002  -17.0931
            15  O3c O    30.7942  -20.7671
            16  O3c O    29.8218  -21.9525
BOND        17
            1     5   6 2
            2     6   7 1
            3     7   8 2
            4     8   9 1
            5     9  10 2
            6    10   5 1
            7     4  11 2
            8     5   1 1
            9     3  12 1
            10    1   2 1
            11   12  13 1
            12    2   3 1
            13   12  14 1
            14    3   4 1
            15    2  15 2
            16    4   6 1
            17    2  16 2

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  All links  
Chemical substance (13)   
   PubChem (1)   
   ChEBI (1)   
   HSDB (1)   
   MASSBANK (9)   
   NIKKAJI (1)   
All databases (13)   

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