KEGG   COMPOUND: C21389
Entry
C21389                      Compound                               

Name
tert-Butyl alcohol;
tert-Butanol
Formula
C4H10O
Exact mass
74.0732
Mol weight
74.1216
Structure
Reaction
Enzyme
Other DBs
PubChem: 328082932
ChEMBL: CHEMBL16502
PDB-CCD: TBU[PDBj]
KCF data

ATOM        5
            1   C1d C    10.5000  -12.6700
            2   C1a C    10.5000  -14.0700
            3   C1a C    11.8524  -12.1100
            4   C1a C     9.2876  -11.9700
            5   O1a O    10.5000  -11.2700
BOND        4
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1

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