CID 61686718

1-(5-amino-2-chlorophenyl)imidazolidin-2-one

Structural Information

Molecular Formula
C9H10ClN3O
SMILES
C1CN(C(=O)N1)C2=C(C=CC(=C2)N)Cl
InChI
InChI=1S/C9H10ClN3O/c10-7-2-1-6(11)5-8(7)13-4-3-12-9(13)14/h1-2,5H,3-4,11H2,(H,12,14)
InChIKey
AJMRHWJDDSTAJA-UHFFFAOYSA-N
Compound name
1-(5-amino-2-chlorophenyl)imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.05124 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.058516 144.9
[M+Na]+ 234.040458 154.0
[M-H]- 210.043964 147.4
[M+NH4]+ 229.085063 162.5
[M+K]+ 250.014398 148.5
[M+H-H2O]+ 194.048500 137.9
[M+HCOO]- 256.049441 160.8
[M+CH3COO]- 270.065091 156.9
[M+Na-2H]- 232.025906 147.2
[M]+ 211.05069142 141.4
[M]- 211.05178858 141.4
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.