KEGG   COMPOUND: C13840
Entry
C13840                      Compound                               
Name
1-Ethyl-2-benzimidazolinone;
1-EBIO
Formula
C9H10N2O
Exact mass
162.0793
Mol weight
162.1885
Structure
Other DBs
CAS: 10045-45-1
PubChem: 854085
ChEBI: 34076
PDB-CCD: 0W8[PDBj]
NIKKAJI: J241.245D
KCF data

ATOM        12
            1   C8x C    24.9977  -17.6958
            2   C8x C    24.9977  -19.0972
            3   C8x C    26.2113  -19.7978
            4   C8y C    27.4248  -19.0972
            5   C8y C    27.4248  -17.6958
            6   C8x C    26.2113  -16.9951
            7   N4y N    28.7576  -19.5302
            8   C8y C    29.5814  -18.3964
            9   N4x N    28.7576  -17.2627
            10  O5x O    30.9768  -18.3964
            11  C1b C    29.1846  -20.8447
            12  C1a C    28.4819  -22.0659
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 1
            9     8   9 1
            10    5   9 1
            11    8  10 2
            12    7  11 1
            13   11  12 1

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