CID 56773866

1-{2-[4-(trifluoromethyl)piperidin-1-yl]ethyl}imidazolidin-2-one

Structural Information

Molecular Formula
C11H18F3N3O
SMILES
C1CN(CCC1C(F)(F)F)CCN2CCNC2=O
InChI
InChI=1S/C11H18F3N3O/c12-11(13,14)9-1-4-16(5-2-9)7-8-17-6-3-15-10(17)18/h9H,1-8H2,(H,15,18)
InChIKey
NQBIMHIJXJNAFK-UHFFFAOYSA-N
Compound name
1-[2-[4-(trifluoromethyl)piperidin-1-yl]ethyl]imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1402 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.14748 161.5
[M+Na]+ 288.12942 166.4
[M-H]- 264.13292 157.6
[M+NH4]+ 283.17402 174.7
[M+K]+ 304.10336 162.3
[M+H-H2O]+ 248.13746 150.5
[M+HCOO]- 310.13840 170.4
[M+CH3COO]- 324.15405 191.7
[M+Na-2H]- 286.11487 160.3
[M]+ 265.13965 150.3
[M]- 265.14075 150.3
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

No patent data available for this compound.