CID 42907684

N-(phenyl(pyridin-2-yl)methyl)pyridine-2-carboxamide

Structural Information

Molecular Formula
C18H15N3O
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=N2)NC(=O)C3=CC=CC=N3
InChI
InChI=1S/C18H15N3O/c22-18(16-11-5-7-13-20-16)21-17(14-8-2-1-3-9-14)15-10-4-6-12-19-15/h1-13,17H,(H,21,22)
InChIKey
CQRZHUMHDKYKQN-UHFFFAOYSA-N
Compound name
N-[phenyl(pyridin-2-yl)methyl]pyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.12152 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.12880 168.0
[M+Na]+ 312.11074 183.2
[M+NH4]+ 307.15534 175.8
[M+K]+ 328.08468 175.0
[M-H]- 288.11424 174.2
[M+Na-2H]- 310.09619 180.3
[M]+ 289.12097 171.9
[M]- 289.12207 171.9
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.