24513
  CDK     0910211423

 14 13  0  0  0  0  0  0  0  0999 V2000
    2.3645    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9370    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2224    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6515    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5080    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3659    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0804    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7949    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5094    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0 
  1 13  1  0  0  0  0 
  2 10  1  0  0  0  0 
  2 14  1  0  0  0  0 
  3  4  1  0  0  0  0 
  3  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  7  1  0  0  0  0 
  6  8  1  0  0  0  0 
  7  9  1  0  0  0  0 
  8 10  1  0  0  0  0 
  9 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
M  END
> <ID>
CHEBI:178468

> <NAME>
1,1-Dimethoxydecane

> <STAR>
2

> <IUPAC_NAME>
1,1-dimethoxydecane

> <FORMULA>
C12H26O2

> <MASS>
202.338

> <MONOISOTOPIC_MASS>
202.19328

> <CHARGE>
0

> <SMILES>
O(C(OC)CCCCCCCCC)C

> <INCHI>
InChI=1S/C12H26O2/c1-4-5-6-7-8-9-10-11-12(13-2)14-3/h12H,4-11H2,1-3H3

> <INCHIKEY>
NCRNCSZWOOYBQF-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
7779-41-1

> <CHEMIDPLUS>
7779-41-1

$$$$