CID 710521

N-benzyl-3-methoxy-n-(2-pyridinyl)benzamide

Structural Information

Molecular Formula
C20H18N2O2
SMILES
COC1=CC=CC(=C1)C(=O)N(CC2=CC=CC=C2)C3=CC=CC=N3
InChI
InChI=1S/C20H18N2O2/c1-24-18-11-7-10-17(14-18)20(23)22(19-12-5-6-13-21-19)15-16-8-3-2-4-9-16/h2-14H,15H2,1H3
InChIKey
OTFBEMDTHNFMGM-UHFFFAOYSA-N
Compound name
N-benzyl-3-methoxy-N-pyridin-2-ylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.13684 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.144116 175.5
[M+Na]+ 341.126058 180.7
[M-H]- 317.129564 184.6
[M+NH4]+ 336.170663 187.6
[M+K]+ 357.099998 176.9
[M+H-H2O]+ 301.134100 164.5
[M+HCOO]- 363.135041 198.8
[M+CH3COO]- 377.150691 211.4
[M+Na-2H]- 339.111506 180.7
[M]+ 318.13629142 176.6
[M]- 318.13738858 176.6
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.