Marvin  01070916452D          

  3  2  0  0  0  0            999 V2000
    0.7145   -0.1375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.1375    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
M  END
> <ID>
CHEBI:51311

> <NAME>
bromoethene

> <STAR>
3

> <SYNONYM>
Vinylbromid; vinyl bromide; monobromoethylene; C2H3Br; bromure de vinyle; bromoethylene; 1-bromoethylene

> <IUPAC_NAME>
bromoethene

> <FORMULA>
C2H3Br

> <MASS>
106.94922

> <MONOISOTOPIC_MASS>
105.94181

> <CHARGE>
0

> <SMILES>
BrC=C

> <INCHI>
InChI=1S/C2H3Br/c1-2-3/h2H,1H2

> <INCHIKEY>
INLLPKCGLOXCIV-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1361370

> <CAS_REGISTRY_NUMBER>
593-60-2

> <GMELIN_REGISTRY_NUMBER>
25458

> <CHEMIDPLUS>
593-60-2

> <KEGG_COMPOUND_ACCESSION>
C19184

> <NIST_CHEMISTRY_WEBBOOK>
593-60-2

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