CID 59675

N-(2-(1-benzimidazolyl)ethyl)-p-methoxybenzamide hydrochloride

Structural Information

Molecular Formula
C17H17N3O2
SMILES
COC1=CC=C(C=C1)C(=O)NCCN2C=NC3=CC=CC=C32
InChI
InChI=1S/C17H17N3O2/c1-22-14-8-6-13(7-9-14)17(21)18-10-11-20-12-19-15-4-2-3-5-16(15)20/h2-9,12H,10-11H2,1H3,(H,18,21)
InChIKey
DWYGIFMNXDULLZ-UHFFFAOYSA-N
Compound name
N-[2-(benzimidazol-1-yl)ethyl]-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.13208 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.13936 167.6
[M+Na]+ 318.12130 175.9
[M-H]- 294.12480 173.0
[M+NH4]+ 313.16590 182.6
[M+K]+ 334.09524 171.2
[M+H-H2O]+ 278.12934 158.1
[M+HCOO]- 340.13028 190.9
[M+CH3COO]- 354.14593 179.2
[M+Na-2H]- 316.10675 173.4
[M]+ 295.13153 171.2
[M]- 295.13263 171.2
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.