CID 6483745

Quinolin-3-ylmethanamine

Structural Information

Molecular Formula

C₁₀H₁₀N₂

SMILES

C1=CC=C2C(=C1)C=C(C=N2)CN

InChI

InChI=1S/C10H10N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,7H,6,11H2

InChIKey

VKKZSJQQRIGUIE-UHFFFAOYSA-N

Compound name

quinolin-3-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 320
Patents: 158.0844 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]+	159.09168	131.3
[M+Na]+	181.07362	145.8
[M+NH4]+	176.11822	141.3
[M+K]+	197.04756	137.9
[M-H]-	157.07712	135.2
[M+Na-2H]-	179.05907	140.1
[M]+	158.08385	134.5
[M]-	158.08495	134.5

Literature stripe

literature stripe

Patent stripe

patents stripe