CID 12850602

1-(piperidin-4-yl)-2,3-dihydro-1h-imidazol-2-one

Structural Information

Molecular Formula
C8H13N3O
SMILES
C1CNCCC1N2C=CNC2=O
InChI
InChI=1S/C8H13N3O/c12-8-10-5-6-11(8)7-1-3-9-4-2-7/h5-7,9H,1-4H2,(H,10,12)
InChIKey
ZYKUMBAVXKKVKL-UHFFFAOYSA-N
Compound name
3-piperidin-4-yl-1H-imidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

167.10587 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.11315 136.7
[M+Na]+ 190.09509 143.1
[M-H]- 166.09859 136.1
[M+NH4]+ 185.13969 153.1
[M+K]+ 206.06903 139.2
[M+H-H2O]+ 150.10313 128.4
[M+HCOO]- 212.10407 152.9
[M+CH3COO]- 226.11972 147.6
[M+Na-2H]- 188.08054 140.4
[M]+ 167.10532 129.1
[M]- 167.10642 129.1
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