CID 763448

294891-58-0

Structural Information

Molecular Formula
C18H13N3O2
SMILES
C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)C4=CC=CO4
InChI
InChI=1S/C18H13N3O2/c22-18(16-6-3-11-23-16)19-13-9-7-12(8-10-13)17-20-14-4-1-2-5-15(14)21-17/h1-11H,(H,19,22)(H,20,21)
InChIKey
KIQKNOSKYQWLAW-UHFFFAOYSA-N
Compound name
N-[4-(1H-benzimidazol-2-yl)phenyl]furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

13
Patents

303.10077 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.10805 166.4
[M+Na]+ 326.08999 175.2
[M-H]- 302.09349 175.2
[M+NH4]+ 321.13459 180.5
[M+K]+ 342.06393 170.5
[M+H-H2O]+ 286.09803 157.8
[M+HCOO]- 348.09897 189.2
[M+CH3COO]- 362.11462 178.4
[M+Na-2H]- 324.07544 171.1
[M]+ 303.10022 167.7
[M]- 303.10132 167.7
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

No patent data available for this compound.