CID 7019

9-aminoacridine

Structural Information

Molecular Formula

C₁₃H₁₀N₂

SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N

InChI

InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)

InChIKey

XJGFWWJLMVZSIG-UHFFFAOYSA-N

Compound name

acridin-9-amine

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 653
References: 8753
Patents: 194.0844 Da
Monoisotopic Mass: 2.8
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]+	195.09168	139.1
[M+Na]+	217.07362	156.3
[M+NH4]+	212.11822	150.0
[M+K]+	233.04756	147.1
[M-H]-	193.07712	144.4
[M+Na-2H]-	215.05907	149.2
[M]+	194.08385	143.4
[M]-	194.08495	143.4

Literature stripe

literature stripe

Patent stripe

patents stripe