CID 42803

4-(9-acridinylamino)aniline

Structural Information

Molecular Formula
C19H15N3
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)N
InChI
InChI=1S/C19H15N3/c20-13-9-11-14(12-10-13)21-19-15-5-1-3-7-17(15)22-18-8-4-2-6-16(18)19/h1-12H,20H2,(H,21,22)
InChIKey
XTJBUPXVQDLXRF-UHFFFAOYSA-N
Compound name
4-N-acridin-9-ylbenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

4
Patents

285.1266 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.13388 166.2
[M+Na]+ 308.11582 184.2
[M+NH4]+ 303.16042 176.7
[M+K]+ 324.08976 173.6
[M-H]- 284.11932 174.4
[M+Na-2H]- 306.10127 178.0
[M]+ 285.12605 171.5
[M]- 285.12715 171.5
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

patents stripe