Marvin  05120617062D          

  8  7  0  0  0  0            999 V2000
   -0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2375   -0.7145    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
  6  3  1  0  0  0  0
  7  6  1  0  0  0  0
  6  5  1  0  0  0  0
  6  1  1  0  0  0  0
  1  2  1  0  0  0  0
  3  8  1  0  0  0  0
  5  4  1  0  0  0  0
M  RGP  3   2   1   4   3   8   2
M  END
> <ID>
CHEBI:26878

> <NAME>
tertiary alcohol

> <DEFINITION>
A tertiary alcohol is a compound in which a hydroxy group, ‒OH, is attached to a saturated carbon atom which has three other carbon atoms attached to it.

> <STAR>
3

> <SYNONYM>
tertiary alcohols; tertiary alcohol

> <FORMULA>
C4H7OR3

> <MASS>
71.09780

> <MONOISOTOPIC_MASS>
71.04969

> <CHARGE>
0

> <SMILES>
OC(C[*])(C[*])C[*]

$$$$