4  3  0  0  0  0  0  0  0  0999 V2000
   26.6000  -19.3200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.7900  -20.0200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4100  -20.0200    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   26.6000  -17.9200    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1  4  1  0     0  0
M  END
> <ID>
CHEBI:81599

> <NAME>
1,1-Dichloroethane

> <STAR>
2

> <FORMULA>
C2H4Cl2

> <MASS>
98.95900

> <MONOISOTOPIC_MASS>
97.96901

> <CHARGE>
0

> <SMILES>
CC(Cl)Cl

> <INCHI>
InChI=1S/C2H4Cl2/c1-2(3)4/h2H,1H3

> <INCHIKEY>
SCYULBFZEHDVBN-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
75-34-3

> <KEGG_COMPOUND_ACCESSION>
C18247

$$$$