KEGG   COMPOUND: C14317
Entry
C14317                      Compound                               
Name
Benz[a]anthracene;
1,2-Benzanthracene
Formula
C18H12
Exact mass
228.0939
Mol weight
228.29
Structure
Other DBs
CAS: 56-55-3
PubChem: 17395317
ChEBI: 51348
NIKKAJI: J2.320E
KCF data

ATOM        18
            1   C8x C    24.5914  -17.2877
            2   C8x C    24.5914  -18.6897
            3   C8x C    25.8085  -19.3906
            4   C8x C    25.8085  -16.5866
            5   C8y C    27.0184  -17.2877
            6   C8y C    27.0125  -18.6897
            7   C8x C    28.2237  -19.3958
            8   C8x C    28.2358  -16.5919
            9   C8y C    29.4470  -17.2980
            10  C8y C    29.5042  -18.6965
            11  C8x C    30.6389  -19.4064
            12  C8x C    31.8562  -18.7184
            13  C8y C    31.8689  -17.3199
            14  C8y C    30.6642  -16.6099
            15  C8x C    33.0876  -16.6307
            16  C8x C    33.1001  -15.2306
            17  C8x C    31.8955  -14.5207
            18  C8x C    30.6767  -15.2098
BOND        21
            1     9   8 2
            2     8   5 1
            3     5   4 2
            4     4   1 1
            5     1   2 2
            6     2   3 1
            7     3   6 2
            8     9  10 1
            9    10  11 1
            10   11  12 2
            11   12  13 1
            12   13  14 2
            13   14   9 1
            14    5   6 1
            15    6   7 1
            16    7  10 2
            17   13  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21   14  18 1

» Japanese version

  All links  
Chemical substance (6)   
   PubChem (1)   
   ChEBI (1)   
   HSDB (1)   
   MASSBANK (2)   
   NIKKAJI (1)   
All databases (6)   

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