CID 47834

66147-61-3

Structural Information

Molecular Formula
C25H25N3O
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CCCCCC(=O)N
InChI
InChI=1S/C25H25N3O/c26-24(29)13-3-1-2-8-18-14-16-19(17-15-18)27-25-20-9-4-6-11-22(20)28-23-12-7-5-10-21(23)25/h4-7,9-12,14-17H,1-3,8,13H2,(H2,26,29)(H,27,28)
InChIKey
FOVSBFJVCHEMEY-UHFFFAOYSA-N
Compound name
6-[4-(acridin-9-ylamino)phenyl]hexanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

383.19977 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.207046 193.4
[M+Na]+ 406.188988 199.5
[M-H]- 382.192494 199.2
[M+NH4]+ 401.233593 204.3
[M+K]+ 422.162928 191.7
[M+H-H2O]+ 366.197030 182.4
[M+HCOO]- 428.197971 213.9
[M+CH3COO]- 442.213621 202.0
[M+Na-2H]- 404.174436 199.6
[M]+ 383.19922142 194.2
[M]- 383.20031858 194.2
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.