CID 11435597

6-chloro-n-methoxy-n-methylnicotinamide

Structural Information

Molecular Formula

C₈H₉ClN₂O₂

SMILES

CN(C(=O)C1=CN=C(C=C1)Cl)OC

InChI

InChI=1S/C8H9ClN2O2/c1-11(13-2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3

InChIKey

IJUKASNMWCZHHA-UHFFFAOYSA-N

Compound name

6-chloro-N-methoxy-N-methylpyridine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 332
Patents: 200.03525 Da
Monoisotopic Mass: 1.3
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]+	201.04253	138.1
[M+Na]+	223.02447	147.0
[M-H]-	199.02797	142.1
[M+NH4]+	218.06907	157.4
[M+K]+	238.99841	145.5
[M+H-H2O]+	183.03251	132.0
[M+HCOO]-	245.03345	158.4
[M+CH3COO]-	259.04910	187.5
[M+Na-2H]-	221.00992	144.2
[M]+	200.03470	142.6
[M]-	200.03580	142.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe