Ketcher 05172211592D 1   1.00000     0.00000     0

  5  4  0     0  0            999 V2000
    8.8207   -9.7695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6867   -9.2695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5527   -9.7695    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.6867   -8.2695    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9546   -9.2695    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  2  4  2  0     0  0
  1  5  1  0     0  0
M  END
> <ID>
CHEBI:191412

> <NAME>
2-aminoacetyl fluoride

> <DEFINITION>
An acyl flouride that is acetyl fluoride substituted by an amino group at position 2. It is a carcinogenic agent which induces hepatocellular carcinoma in rodents.

> <STAR>
3

> <SYNONYM>
H-Gly-F; 2-aminoethanoyl fluoride; 2-aminoacetylfluorine

> <IUPAC_NAME>
glycyl fluoride

> <FORMULA>
C2H4FNO

> <MASS>
77.058

> <MONOISOTOPIC_MASS>
77.02769

> <CHARGE>
0

> <SMILES>
NCC(F)=O

> <INCHI>
InChI=1S/C2H4FNO/c3-2(5)1-4/h1,4H2

> <INCHIKEY>
SQRVIASYMYTAPM-UHFFFAOYSA-N

> <PUBMED_CITATION>
22121493; 28876464; 29732980; 30324893; 3416305

$$$$