CID 45032

63887-19-4

Structural Information

Molecular Formula
C14H12N4O
SMILES
C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC=C(C=C3)N
InChI
InChI=1S/C14H12N4O/c15-10-7-5-9(6-8-10)13(19)18-14-16-11-3-1-2-4-12(11)17-14/h1-8H,15H2,(H2,16,17,18,19)
InChIKey
AAXLOKUTFYXXMQ-UHFFFAOYSA-N
Compound name
4-amino-N-(1H-benzimidazol-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

252.1011 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.10838 155.4
[M+Na]+ 275.09032 168.3
[M+NH4]+ 270.13492 162.9
[M+K]+ 291.06426 163.7
[M-H]- 251.09382 159.2
[M+Na-2H]- 273.07577 163.6
[M]+ 252.10055 158.1
[M]- 252.10165 158.1
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