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]+ 384.20705 193.4
[M+Na]+ 406.18899 199.5
[M-H]- 382.19249 199.2
[M+NH4]+ 401.23359 204.3
[M+K]+ 422.16293 191.7
[M+H-H2O]+ 366.19703 182.4
[M+HCOO]- 428.19797 213.9
[M+CH3COO]- 442.21362 202.0
[M+Na-2H]- 404.17444 199.6
[M]+ 383.19922 194.2
[M]- 383.20032 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.