KEGG   COMPOUND: C14330
Entry
C14330                      Compound                               
Name
2,6-Dimethylnaphthalene
Formula
C12H12
Exact mass
156.0939
Mol weight
156.2237
Structure
Other DBs
CAS: 581-42-0
PubChem: 17395330
ChEBI: 34251
NIKKAJI: J45.113D
KCF data

ATOM        12
            1   C8x C    26.4028  -16.2528
            2   C8y C    26.4028  -17.6540
            3   C8x C    27.6164  -18.3546
            4   C8y C    28.8301  -17.6540
            5   C8y C    28.8301  -16.2528
            6   C8x C    27.6164  -15.5521
            7   C8x C    30.0436  -18.3546
            8   C8x C    31.2571  -17.6540
            9   C8y C    31.2571  -16.2528
            10  C8x C    30.0436  -15.5521
            11  C1a C    32.4558  -15.5605
            12  C1a C    25.1889  -18.3549
BOND        13
            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     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    9  11 1
            13    2  12 1

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Chemical substance (5)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   MASSBANK (1)   
   NIKKAJI (1)   
All databases (5)   

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