CID 80480

1-(2-aminoethyl)imidazolidin-2-one

Structural Information

Molecular Formula
C5H11N3O
SMILES
C1CN(C(=O)N1)CCN
InChI
InChI=1S/C5H11N3O/c6-1-3-8-4-2-7-5(8)9/h1-4,6H2,(H,7,9)
InChIKey
PODSUMUEKRUDEI-UHFFFAOYSA-N
Compound name
1-(2-aminoethyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2438
Patents

129.09021 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.097486 127.0
[M+Na]+ 152.079428 133.9
[M-H]- 128.082934 125.8
[M+NH4]+ 147.124033 146.9
[M+K]+ 168.053368 132.1
[M+H-H2O]+ 112.087470 120.2
[M+HCOO]- 174.088411 147.4
[M+CH3COO]- 188.104061 169.2
[M+Na-2H]- 150.064876 131.0
[M]+ 129.08966142 121.7
[M]- 129.09075858 121.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe