CID 45158668

915402-26-5

Structural Information

Molecular Formula
C9H7FN2O
SMILES
C1=CC(=CC=C1C2=CNC(=O)N2)F
InChI
InChI=1S/C9H7FN2O/c10-7-3-1-6(2-4-7)8-5-11-9(13)12-8/h1-5H,(H2,11,12,13)
InChIKey
BQXQFSPPZOFLRU-UHFFFAOYSA-N
Compound name
4-(4-fluorophenyl)-1,3-dihydroimidazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

178.05424 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.061516 133.0
[M+Na]+ 201.043458 143.2
[M-H]- 177.046964 134.0
[M+NH4]+ 196.088063 151.0
[M+K]+ 217.017398 138.0
[M+H-H2O]+ 161.051500 125.1
[M+HCOO]- 223.052441 153.6
[M+CH3COO]- 237.068091 146.0
[M+Na-2H]- 199.028906 138.3
[M]+ 178.05369142 128.9
[M]- 178.05478858 128.9
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