KEGG   COMPOUND: C19409
Entry
C19409                      Compound                               
Name
Dinitrosopentamethylenetetramine
Formula
C5H10N6O2
Exact mass
186.0865
Mol weight
186.1719
Structure
Other DBs
CAS: 101-25-7
PubChem: 124490081
ChEBI: 82457
KCF data

ATOM        13
            1   C1x C    27.5507  -15.1568
            2   N1y N    28.8622  -15.1568
            3   C1x C    29.7915  -16.0793
            4   N1y N    29.7915  -17.3908
            5   C1x C    28.8622  -18.3201
            6   N1y N    27.5507  -18.3201
            7   C1x C    26.6280  -17.3908
            8   N1y N    26.6280  -16.0793
            9   C1x C    28.8622  -17.0570
            10  N2b N    25.5152  -15.4048
            11  N2b N    30.9304  -18.0259
            12  O3a O    32.1428  -18.7259
            13  O3a O    24.3728  -14.6348
BOND        14
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   1 1
            9     2   9 1
            10    6   9 1
            11    8  10 1
            12    4  11 1
            13   11  12 2
            14   10  13 2

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Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   HSDB (1)   
All databases (3)   

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