CID 24947623

2-chloro-5-phenyl-1h-imidazole

Structural Information

Molecular Formula
C9H7ClN2
SMILES
C1=CC=C(C=C1)C2=CN=C(N2)Cl
InChI
InChI=1S/C9H7ClN2/c10-9-11-6-8(12-9)7-4-2-1-3-5-7/h1-6H,(H,11,12)
InChIKey
YCUAGVOYWABQQQ-UHFFFAOYSA-N
Compound name
2-chloro-5-phenyl-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

178.02977 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.03705 134.6
[M+Na]+ 201.01899 149.8
[M+NH4]+ 196.06359 144.0
[M+K]+ 216.99293 143.6
[M-H]- 177.02249 137.7
[M+Na-2H]- 199.00444 144.1
[M]+ 178.02922 138.0
[M]- 178.03032 138.0
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