KEGG   COMPOUND: C20645
Entry
C20645                      Compound                               
Name
Methyl benzoate
Formula
C8H8O2
Exact mass
136.0524
Mol weight
136.1479
Structure
Reaction
R10447
Enzyme
2.1.1.273
Other DBs
CAS: 93-58-3
PubChem: 172232369
LinkDB
KCF data

ATOM        10
            1   C8x C    15.1200  -17.2200
            2   C8x C    16.3100  -17.9200
            3   C8x C    17.5000  -17.2200
            4   C8x C    17.5000  -15.8200
            5   C8y C    16.3100  -15.1200
            6   C8x C    15.1200  -15.8200
            7   C7a C    16.3100  -13.7200
            8   O7a O    17.5700  -13.0200
            9   O6a O    15.1200  -13.0200
            10  C1a C    18.7600  -13.7200
BOND        10
            1     5   6 2
            2     6   1 1
            3     5   7 1
            4     1   2 2
            5     7   8 1
            6     2   3 1
            7     7   9 2
            8     3   4 2
            9     4   5 1
            10    8  10 1

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