CID 19017767

4-chloro-1h-benzo[d]imidazol-2-amine

Structural Information

Molecular Formula
C7H6ClN3
SMILES
C1=CC2=C(C(=C1)Cl)N=C(N2)N
InChI
InChI=1S/C7H6ClN3/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H3,9,10,11)
InChIKey
WDGDTHWKGHBYNL-UHFFFAOYSA-N
Compound name
4-chloro-1H-benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

167.02502 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.03230 128.5
[M+Na]+ 190.01424 142.8
[M+NH4]+ 185.05884 137.7
[M+K]+ 205.98818 137.7
[M-H]- 166.01774 130.4
[M+Na-2H]- 187.99969 135.7
[M]+ 167.02447 131.3
[M]- 167.02557 131.3
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