CID 595276

2-methoxy-4,6-dimethylnicotinonitrile

Structural Information

Molecular Formula

C₉H₁₀N₂O

SMILES

CC1=CC(=NC(=C1C#N)OC)C

InChI

InChI=1S/C9H10N2O/c1-6-4-7(2)11-9(12-3)8(6)5-10/h4H,1-3H3

InChIKey

WEJLKGQPSKTCBR-UHFFFAOYSA-N

Compound name

2-methoxy-4,6-dimethylpyridine-3-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 97
Patents: 162.07932 Da
Monoisotopic Mass: 1.6
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]+	163.08660	132.8
[M+Na]+	185.06854	146.2
[M+NH4]+	180.11314	137.8
[M+K]+	201.04248	136.9
[M-H]-	161.07204	127.5
[M+Na-2H]-	183.05399	137.3
[M]+	162.07877	132.4
[M]-	162.07987	132.4

Literature stripe

literature stripe

Patent stripe

patents stripe