KEGG   COMPOUND: C19266Help
Entry
C19266                      Compound                               

Name
4,4'-Bis(dimethylamino)benzophenone;
Michler's ketone
Formula
C17H20N2O
Exact mass
268.1576
Mol weight
268.3535
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C19266  Michler's ketone
BRITE hierarchy
Other DBs
CAS: 90-94-8
PubChem: 124489938
ChEBI: 82347
ChEMBL: CHEMBL15137
LinkDB All DBs
KCF data Show

ATOM        20
            1   C1a C    22.2600  -16.7300
            2   C1a C    23.4500  -18.7600
            3   C1a C    34.3700  -16.6600
            4   C1a C    33.1800  -18.7600
            5   C8x C    25.9000  -14.5600
            6   C8x C    27.0900  -16.6600
            7   C8x C    29.5400  -16.6600
            8   C8x C    30.7300  -14.5600
            9   C8x C    24.7100  -15.2600
            10  C8x C    25.9000  -17.3600
            11  C8x C    30.7300  -17.3600
            12  C8x C    31.9200  -15.2600
            13  C5a C    28.2800  -14.5600
            14  C8y C    27.0900  -15.2600
            15  C8y C    29.5400  -15.2600
            16  C8y C    24.7100  -16.6600
            17  C8y C    31.9200  -16.6600
            18  N1c N    23.4500  -17.3600
            19  N1c N    33.1800  -17.3600
            20  O5a O    28.2628  -13.1601
BOND        21
            1     1  18 1
            2     2  18 1
            3     3  19 1
            4     4  19 1
            5     5   9 2
            6     5  14 1
            7     6  10 1
            8     6  14 2
            9     7  11 2
            10    7  15 1
            11    8  12 1
            12    8  15 2
            13    9  16 1
            14   10  16 2
            15   11  17 1
            16   12  17 2
            17   13  14 1
            18   13  15 1
            19   16  18 1
            20   17  19 1
            21   13  20 2

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