CID 16792972

2-amino-n-(6-methoxypyridin-3-yl)benzamide

Structural Information

Molecular Formula

C₁₃H₁₃N₃O₂

SMILES

COC1=NC=C(C=C1)NC(=O)C2=CC=CC=C2N

InChI

InChI=1S/C13H13N3O2/c1-18-12-7-6-9(8-15-12)16-13(17)10-4-2-3-5-11(10)14/h2-8H,14H2,1H3,(H,16,17)

InChIKey

IOSOQMDKQXGSCN-UHFFFAOYSA-N

Compound name

2-amino-N-(6-methoxy-3-pyridinyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 243.10077 Da
Monoisotopic Mass: 1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	244.108046	153.7
[M+Na]+	266.089988	160.8
[M-H]-	242.093494	159.0
[M+NH4]+	261.134593	168.8
[M+K]+	282.063928	157.6
[M+H-H2O]+	226.098030	145.0
[M+HCOO]-	288.098971	178.2
[M+CH3COO]-	302.114621	196.8
[M+Na-2H]-	264.075436	159.5
[M]+	243.10022142	152.7
[M]-	243.10131858	152.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.