CID 6444431

Brn 1530947

Structural Information

Molecular Formula
C12H20N2O
SMILES
C1CCN(C1)C/C=C\CN2CCCC2=O
InChI
InChI=1S/C12H20N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h3-4H,1-2,5-11H2/b4-3-
InChIKey
HOYGXWYHYSYOHL-ARJAWSKDSA-N
Compound name
1-[(Z)-4-pyrrolidin-1-ylbut-2-enyl]pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.15756 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.16484 153.1
[M+Na]+ 231.14678 161.2
[M+NH4]+ 226.19138 160.4
[M+K]+ 247.12072 158.3
[M-H]- 207.15028 154.0
[M+Na-2H]- 229.13223 156.0
[M]+ 208.15701 154.0
[M]- 208.15811 154.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.