CID 4712456

1-[2-(4-piperidinyl)ethyl]-2-pyrrolidinone

Structural Information

Molecular Formula
C11H20N2O
SMILES
C1CC(=O)N(C1)CCC2CCNCC2
InChI
InChI=1S/C11H20N2O/c14-11-2-1-8-13(11)9-5-10-3-6-12-7-4-10/h10,12H,1-9H2
InChIKey
VXEDMQRKJUGYBQ-UHFFFAOYSA-N
Compound name
1-(2-piperidin-4-ylethyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

196.15756 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.16484 148.5
[M+Na]+ 219.14678 151.8
[M-H]- 195.15028 149.4
[M+NH4]+ 214.19138 165.5
[M+K]+ 235.12072 148.8
[M+H-H2O]+ 179.15482 140.2
[M+HCOO]- 241.15576 163.5
[M+CH3COO]- 255.17141 179.8
[M+Na-2H]- 217.13223 149.0
[M]+ 196.15701 140.3
[M]- 196.15811 140.3
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

patents stripe