15774823
  CDK     0409211652

  9  9  0  0  0  0  0  0  0  0999 V2000
    1.6500   -0.4285    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790    0.3965    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7465    0.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4115    0.8814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4915    1.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6665    1.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790   -0.4285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645   -0.8410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645   -1.6660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  2  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  2  7  1  0  0  0  0 
  3  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  6  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
M  END
> <ID>
CHEBI:169194

> <NAME>
1-(1-Pyrrolidinyl)-2-propanone

> <STAR>
2

> <IUPAC_NAME>
1-pyrrolidin-1-ylpropan-2-one

> <FORMULA>
C7H13NO

> <MASS>
127.187

> <MONOISOTOPIC_MASS>
127.09971

> <CHARGE>
0

> <SMILES>
O=C(CN1CCCC1)C

> <INCHI>
InChI=1S/C7H13NO/c1-7(9)6-8-4-2-3-5-8/h2-6H2,1H3

> <INCHIKEY>
YZZYFRBPGIXHPD-UHFFFAOYSA-N

$$$$