CID 215933

36845-10-0

Structural Information

Molecular Formula

C₁₄H₁₅N₃O

SMILES

CC1=CC(=NC(=C1)NC(=O)C2=CC=C(C=C2)N)C

InChI

InChI=1S/C14H15N3O/c1-9-7-10(2)16-13(8-9)17-14(18)11-3-5-12(15)6-4-11/h3-8H,15H2,1-2H3,(H,16,17,18)

InChIKey

FEWVYFMOKCOJNJ-UHFFFAOYSA-N

Compound name

4-amino-N-(4,6-dimethylpyridin-2-yl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 241.1215 Da
Monoisotopic Mass: 2.1
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]+	242.12878	155.7
[M+Na]+	264.11072	163.5
[M-H]-	240.11422	161.3
[M+NH4]+	259.15532	171.3
[M+K]+	280.08466	159.4
[M+H-H2O]+	224.11876	147.4
[M+HCOO]-	286.11970	179.6
[M+CH3COO]-	300.13535	198.8
[M+Na-2H]-	262.09617	160.2
[M]+	241.12095	154.1
[M]-	241.12205	154.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.