CID 22000

10-methylacridinium perchlorate

Structural Information

Molecular Formula

C₁₄H₁₂N

SMILES

C[N+]1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C14H12N/c1-15-13-8-4-2-6-11(13)10-12-7-3-5-9-14(12)15/h2-10H,1H3/q+1

InChIKey

GXYLXFITCXXCQV-UHFFFAOYSA-N

Compound name

10-methylacridin-10-ium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 31
References: 733
Patents: 194.09697 Da
Monoisotopic Mass: 3.7
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]+	195.10425	141.5
[M+Na]+	217.08619	152.3
[M-H]-	193.08969	146.6
[M+NH4]+	212.13079	161.8
[M+K]+	233.06013	141.9
[M+H-H2O]+	177.09423	136.9
[M+HCOO]-	239.09517	163.9
[M+CH3COO]-	253.11082	180.0
[M+Na-2H]-	215.07164	155.0
[M]+	194.09642	142.2
[M]-	194.09752	142.2

Literature stripe

literature stripe

Patent stripe

patents stripe