CID 2799581

2-chloro-6-methylnicotinamide

Structural Information

Molecular Formula

C₇H₇ClN₂O

SMILES

CC1=NC(=C(C=C1)C(=O)N)Cl

InChI

InChI=1S/C7H7ClN2O/c1-4-2-3-5(7(9)11)6(8)10-4/h2-3H,1H3,(H2,9,11)

InChIKey

QFRWKKWOCPTEKS-UHFFFAOYSA-N

Compound name

2-chloro-6-methylpyridine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 47
Patents: 170.02469 Da
Monoisotopic Mass: 1.1
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]+	171.03197	131.3
[M+Na]+	193.01391	144.7
[M+NH4]+	188.05851	139.6
[M+K]+	208.98785	138.7
[M-H]-	169.01741	133.1
[M+Na-2H]-	190.99936	138.1
[M]+	170.02414	133.9
[M]-	170.02524	133.9

Literature stripe

literature stripe

Patent stripe

patents stripe