CID 13415150

3-(dimethylamino)picolinonitrile

Structural Information

Molecular Formula

C₈H₉N₃

SMILES

CN(C)C1=C(N=CC=C1)C#N

InChI

InChI=1S/C8H9N3/c1-11(2)8-4-3-5-10-7(8)6-9/h3-5H,1-2H3

InChIKey

RQVRKBRGGTZDOH-UHFFFAOYSA-N

Compound name

3-(dimethylamino)pyridine-2-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 147.07965 Da
Monoisotopic Mass: 1.0
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]+	148.08693	133.1
[M+Na]+	170.06887	145.4
[M+NH4]+	165.11347	138.4
[M+K]+	186.04281	136.1
[M-H]-	146.07237	128.6
[M+Na-2H]-	168.05432	138.3
[M]+	147.07910	132.7
[M]-	147.08020	132.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe