Marvin  10120615562D          

  5  5  0  0  0  0            999 V2000
    0.6675   -0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6674   -0.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -1.2696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -1.2696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1  4  1  0  0  0  0
  5  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
M  END
> <ID>
CHEBI:20198

> <NAME>
3-pyrroline

> <STAR>
3

> <SYNONYM>
Delta(3)-pyrroline; 3-pyrroline; 2,5-dihydropyrrole

> <IUPAC_NAME>
2,5-dihydro-1H-pyrrole

> <FORMULA>
C4H7N

> <MASS>
69.10512

> <MONOISOTOPIC_MASS>
69.05785

> <CHARGE>
0

> <SMILES>
C1NCC=C1

> <INCHI>
InChI=1S/C4H7N/c1-2-4-5-3-1/h1-2,5H,3-4H2

> <INCHIKEY>
JVQIKJMSUIMUDI-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
103173

> <CAS_REGISTRY_NUMBER>
109-96-6

> <GMELIN_REGISTRY_NUMBER>
25676

> <CHEMIDPLUS>
109-96-6

> <NIST_CHEMISTRY_WEBBOOK>
109-96-6

$$$$