CID 12291887

10(9h)-acridinecarboxaldehyde

Structural Information

Molecular Formula

C₁₄H₁₁NO

SMILES

C1C2=CC=CC=C2N(C3=CC=CC=C31)C=O

InChI

InChI=1S/C14H11NO/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-8,10H,9H2

InChIKey

XJKJXUQDRFDTOU-UHFFFAOYSA-N

Compound name

9H-acridine-10-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 209.08406 Da
Monoisotopic Mass: 2.9
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]+	210.091336	143.3
[M+Na]+	232.073278	152.5
[M-H]-	208.076784	147.4
[M+NH4]+	227.117883	162.9
[M+K]+	248.047218	147.7
[M+H-H2O]+	192.081320	135.7
[M+HCOO]-	254.082261	163.6
[M+CH3COO]-	268.097911	156.3
[M+Na-2H]-	230.058726	152.8
[M]+	209.08351142	142.9
[M]-	209.08460858	142.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe