CID 50357

Acridine, 9-(p-(butylamino)anilino)-

Structural Information

Molecular Formula
C23H23N3
SMILES
CCCCNC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C23H23N3/c1-2-3-16-24-17-12-14-18(15-13-17)25-23-19-8-4-6-10-21(19)26-22-11-7-5-9-20(22)23/h4-15,24H,2-3,16H2,1H3,(H,25,26)
InChIKey
YWHLTEIENBYNDH-UHFFFAOYSA-N
Compound name
4-N-acridin-9-yl-1-N-butylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

341.1892 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.19648 181.0
[M+Na]+ 364.17842 188.3
[M-H]- 340.18192 187.6
[M+NH4]+ 359.22302 194.2
[M+K]+ 380.15236 180.5
[M+H-H2O]+ 324.18646 170.3
[M+HCOO]- 386.18740 203.6
[M+CH3COO]- 400.20305 191.0
[M+Na-2H]- 362.16387 190.4
[M]+ 341.18865 182.0
[M]- 341.18975 182.0
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.