CID 3769682

25810-58-6

Structural Information

Molecular Formula
C16H15N3O
SMILES
CC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C16H15N3O/c1-11(17-16(20)12-7-3-2-4-8-12)15-18-13-9-5-6-10-14(13)19-15/h2-11H,1H3,(H,17,20)(H,18,19)
InChIKey
HBXCANPHKBFHMH-UHFFFAOYSA-N
Compound name
N-[1-(1H-benzimidazol-2-yl)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.12152 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.12880 159.9
[M+Na]+ 288.11074 167.2
[M-H]- 264.11424 163.9
[M+NH4]+ 283.15534 175.2
[M+K]+ 304.08468 161.9
[M+H-H2O]+ 248.11878 151.2
[M+HCOO]- 310.11972 181.0
[M+CH3COO]- 324.13537 171.1
[M+Na-2H]- 286.09619 165.5
[M]+ 265.12097 159.0
[M]- 265.12207 159.0
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.