CID 18615674

162960-28-3

Structural Information

Molecular Formula

C₉H₈N₂

SMILES

C1CC1(C#N)C2=CC=CC=N2

InChI

InChI=1S/C9H8N2/c10-7-9(4-5-9)8-3-1-2-6-11-8/h1-3,6H,4-5H2

InChIKey

GAEVNPHZQRROPK-UHFFFAOYSA-N

Compound name

1-pyridin-2-ylcyclopropane-1-carbonitrile

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 144.06874 Da
Monoisotopic Mass: 0.9
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]+	145.07602	134.6
[M+Na]+	167.05796	148.8
[M+NH4]+	162.10256	142.3
[M+K]+	183.03190	138.7
[M-H]-	143.06146	137.3
[M+Na-2H]-	165.04341	144.3
[M]+	144.06819	137.9
[M]-	144.06929	137.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe