CID 140457

8-aminoquinaldine

Structural Information

Molecular Formula

C₁₀H₁₀N₂

SMILES

CC1=NC2=C(C=CC=C2N)C=C1

InChI

InChI=1S/C10H10N2/c1-7-5-6-8-3-2-4-9(11)10(8)12-7/h2-6H,11H2,1H3

InChIKey

JHIAOWGCGNMQKA-UHFFFAOYSA-N

Compound name

2-methylquinolin-8-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 10
References: 819
Patents: 158.0844 Da
Monoisotopic Mass: 2.0
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	131.2
[M+Na]+	181.07362	146.0
[M+NH4]+	176.11822	141.2
[M+K]+	197.04756	138.3
[M-H]-	157.07712	135.1
[M+Na-2H]-	179.05907	139.7
[M]+	158.08385	134.5
[M]-	158.08495	134.5

Literature stripe

literature stripe

Patent stripe

patents stripe