CID 68282

1125-96-8

Structural Information

Molecular Formula

C₉H₁₀N₂

SMILES

C1CNC(=C1)C2=CN=CC=C2

InChI

InChI=1S/C9H10N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3-5,7,11H,2,6H2

InChIKey

VSECEWAIAJHRGJ-UHFFFAOYSA-N

Compound name

3-(2,3-dihydro-1H-pyrrol-5-yl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 776
Patents: 146.0844 Da
Monoisotopic Mass: 1.4
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]+	147.09168	130.7
[M+Na]+	169.07362	143.8
[M+NH4]+	164.11822	139.8
[M+K]+	185.04756	138.5
[M-H]-	145.07712	133.6
[M+Na-2H]-	167.05907	139.4
[M]+	146.08385	133.3
[M]-	146.08495	133.3

Literature stripe

literature stripe

Patent stripe

patents stripe