CID 2094705

N-(1h-benzimidazol-2-yl)-4-chlorobenzamide

Structural Information

Molecular Formula
C14H10ClN3O
SMILES
C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H10ClN3O/c15-10-7-5-9(6-8-10)13(19)18-14-16-11-3-1-2-4-12(11)17-14/h1-8H,(H2,16,17,18,19)
InChIKey
CERLGXAGGNYXLC-UHFFFAOYSA-N
Compound name
N-(1H-benzimidazol-2-yl)-4-chlorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

5
Patents

271.05124 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.05852 158.0
[M+Na]+ 294.04046 173.4
[M+NH4]+ 289.08506 166.5
[M+K]+ 310.01440 167.2
[M-H]- 270.04396 161.8
[M+Na-2H]- 292.02591 167.0
[M]+ 271.05069 161.6
[M]- 271.05179 161.6
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