CID 3063923

N-methoxynicotinamide hydrochloride

Structural Information

Molecular Formula

C₇H₈N₂O₂

SMILES

CONC(=O)C1=CN=CC=C1

InChI

InChI=1S/C7H8N2O2/c1-11-9-7(10)6-3-2-4-8-5-6/h2-5H,1H3,(H,9,10)

InChIKey

BNYNWZAYGHFSAD-UHFFFAOYSA-N

Compound name

N-methoxypyridine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 152.05858 Da
Monoisotopic Mass: 0.0
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]+	153.065856	128.7
[M+Na]+	175.047798	136.2
[M-H]-	151.051304	131.2
[M+NH4]+	170.092403	148.1
[M+K]+	191.021738	135.5
[M+H-H2O]+	135.055840	121.9
[M+HCOO]-	197.056781	153.4
[M+CH3COO]-	211.072431	176.0
[M+Na-2H]-	173.033246	137.2
[M]+	152.05803142	129.1
[M]-	152.05912858	129.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe