KEGG   COMPOUND: C03500Help
Entry
C03500                      Compound                               

Name
Ethyl 3-oxobutanoate;
Ethyl acetoacetate
Formula
C6H10O3
Exact mass
130.063
Mol weight
130.1418
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
141-97-9
PubChem: 
PDB-CCD: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        9
            1   C1b C    25.8539  -16.0517
            2   C7a C    27.0710  -15.3500
            3   C5a C    24.6435  -15.3500
            4   O7a O    28.2813  -16.0517
            5   O6a O    27.0710  -13.9527
            6   C1a C    23.4329  -16.0517
            7   O5a O    24.6435  -13.9527
            8   C1b C    29.4924  -15.3300
            9   C1a C    30.7049  -16.0300
BOND        8
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 2
            5     3   6 1
            6     3   7 2
            7     4   8 1
            8     8   9 1

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