Marvin  07190711152D          

  4  3  0  0  0  0            999 V2000
   -0.8250    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
  2  3  1  0  0  0  0
  4  3  1  0  0  0  0
M  END
> <ID>
CHEBI:38907

> <NAME>
methyl cyanate

> <STAR>
3

> <SYNONYM>
methylcyanate; Methylcyanat; MeOCN

> <IUPAC_NAME>
methyl cyanate

> <FORMULA>
C2H3NO

> <MASS>
57.05136

> <MONOISOTOPIC_MASS>
57.02146

> <CHARGE>
0

> <SMILES>
COC#N

> <INCHI>
InChI=1S/C2H3NO/c1-4-2-3/h1H3

> <INCHIKEY>
JYQQWQJCEUMXQZ-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
1900736

> <CAS_REGISTRY_NUMBER>
1768-34-9

> <GMELIN_REGISTRY_NUMBER>
2431261

> <CHEMIDPLUS>
1768-34-9

> <NIST_CHEMISTRY_WEBBOOK>
1768-34-9

$$$$