CID 672245

N-(1h-benzoimidazol-2-yl)-benzene-1,2-diamine

Structural Information

Molecular Formula
C13H12N4
SMILES
C1=CC=C(C(=C1)N)NC2=NC3=CC=CC=C3N2
InChI
InChI=1S/C13H12N4/c14-9-5-1-2-6-10(9)15-13-16-11-7-3-4-8-12(11)17-13/h1-8H,14H2,(H2,15,16,17)
InChIKey
ZZDGNBWCSPZNRU-UHFFFAOYSA-N
Compound name
2-N-(1H-benzimidazol-2-yl)benzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

42
Patents

224.1062 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.11348 148.0
[M+Na]+ 247.09542 161.9
[M+NH4]+ 242.14002 156.7
[M+K]+ 263.06936 156.3
[M-H]- 223.09892 152.8
[M+Na-2H]- 245.08087 157.4
[M]+ 224.10565 151.3
[M]- 224.10675 151.3
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