CID 53335

9-(o-isopropylanilino)acridine hydrochloride

Structural Information

Molecular Formula
C22H20N2
SMILES
CC(C)C1=CC=CC=C1NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C22H20N2/c1-15(2)16-9-3-6-12-19(16)24-22-17-10-4-7-13-20(17)23-21-14-8-5-11-18(21)22/h3-15H,1-2H3,(H,23,24)
InChIKey
XQYXUACMFMBAOZ-UHFFFAOYSA-N
Compound name
N-(2-propan-2-ylphenyl)acridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

312.16266 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.169936 174.9
[M+Na]+ 335.151878 183.2
[M-H]- 311.155384 181.9
[M+NH4]+ 330.196483 189.6
[M+K]+ 351.125818 176.0
[M+H-H2O]+ 295.159920 164.8
[M+HCOO]- 357.160861 195.8
[M+CH3COO]- 371.176511 185.8
[M+Na-2H]- 333.137326 182.9
[M]+ 312.16211142 175.6
[M]- 312.16320858 175.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.