CID 26671

9-(o-chloroanilino)acridine hydrochloride

Structural Information

Molecular Formula

C₁₉H₁₃ClN₂

SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=CC=C4Cl

InChI

InChI=1S/C19H13ClN2/c20-15-9-3-6-12-18(15)22-19-13-7-1-4-10-16(13)21-17-11-5-2-8-14(17)19/h1-12H,(H,21,22)

InChIKey

JWJNRFPYXGTVPU-UHFFFAOYSA-N

Compound name

N-(2-chlorophenyl)acridin-9-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 304.07672 Da
Monoisotopic Mass: 5.7
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]+	305.083996	167.5
[M+Na]+	327.065938	178.5
[M-H]-	303.069444	174.7
[M+NH4]+	322.110543	183.6
[M+K]+	343.039878	170.0
[M+H-H2O]+	287.073980	158.4
[M+HCOO]-	349.074921	186.0
[M+CH3COO]-	363.090571	179.5
[M+Na-2H]-	325.051386	177.8
[M]+	304.07617142	170.4
[M]-	304.07726858	170.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.