KEGG   COMPOUND: C14742
Entry
C14742                      Compound                               
Name
N-Nitrosodiphenylamine
Formula
C12H10N2O
Exact mass
198.0793
Mol weight
198.2206
Structure
Other DBs
CAS: 86-30-6
PubChem: 17395740
ChEBI: 34875
NIKKAJI: J3.893H
LinkDB
KCF data

ATOM        15
            1   C8x C    16.1000  -18.3400
            2   C8x C    16.1000  -19.7400
            3   C8x C    17.3124  -20.4400
            4   C8x C    18.5249  -19.7400
            5   C8y C    18.5249  -18.3400
            6   C8x C    17.3124  -17.6400
            7   N1c N    19.7560  -17.6290
            8   C8y C    20.9612  -18.3247
            9   C8x C    20.9616  -19.7396
            10  C8x C    22.1742  -20.4393
            11  C8x C    23.3865  -19.7389
            12  C8x C    23.3860  -18.3239
            13  C8x C    22.1734  -17.6243
            14  N2b N    19.7557  -16.2401
            15  O3a O    18.5314  -15.5334
BOND        16
            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     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15    7  14 1
            16   14  15 2

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