KEGG   COMPOUND: C06648
Entry
C06648                      Compound                               
Name
4-Chlorobenzaldehyde
Formula
C7H5ClO
Exact mass
140.0029
Mol weight
140.567
Structure
Reaction
R05252 R05344
Enzyme
1.2.-.-
Other DBs
CAS: 104-88-1
PubChem: 8874
3DMET: B01017
NIKKAJI: J96.206F
LinkDB
KCF data

ATOM        9
            1   C8y C    28.5988  -19.5610
            2   C8x C    28.5988  -20.9668
            3   C8x C    27.3864  -18.8639
            4   C4a C    29.8112  -18.8639
            5   C8x C    27.3864  -21.6637
            6   C8x C    26.1738  -19.5610
            7   C8y C    26.1738  -20.9668
            8   X   Cl   24.9614  -21.6637
            9   O4a O    31.0141  -19.5609
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     7   8 1
            8     6   7 2
            9     4   9 2

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