Marvin  06051315262D          

  9 10  0  0  0  0            999 V2000
   16.3523  -12.2211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6539  -11.8086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8678  -12.8886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6539  -12.6336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8678  -11.5536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3685  -11.3961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0831  -12.6336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3685  -13.0461    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.0831  -11.8086    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  1  5  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
M  END
> <ID>
CHEBI:73949

> <NAME>
1,5-diazabicyclo[4.3.0]nonane

> <DEFINITION>
An azabicycloalkane that consists of a hexahydropyrimidine ring fused with a cyclopentane ring at positions 2 and 3.

> <STAR>
3

> <IUPAC_NAME>
octahydropyrrolo[1,2-a]pyrimidine

> <FORMULA>
C7H14N2

> <MASS>
126.19950

> <MONOISOTOPIC_MASS>
126.11570

> <CHARGE>
0

> <SMILES>
C1CNC2CCCN2C1

> <INCHI>
InChI=1S/C7H14N2/c1-3-7-8-4-2-6-9(7)5-1/h7-8H,1-6H2

> <INCHIKEY>
IHGJZNUBLMAEGL-UHFFFAOYSA-N

> <REAXYS_REGISTRY_NUMBER>
4174334

$$$$