CID 47838

66147-69-1

Structural Information

Molecular Formula
C25H27N3O2S
SMILES
CCCCCCS(=O)(=O)NC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C25H27N3O2S/c1-2-3-4-9-18-31(29,30)28-20-16-14-19(15-17-20)26-25-21-10-5-7-12-23(21)27-24-13-8-6-11-22(24)25/h5-8,10-17,28H,2-4,9,18H2,1H3,(H,26,27)
InChIKey
PGPNVVHFHOGGFM-UHFFFAOYSA-N
Compound name
N-[4-(acridin-9-ylamino)phenyl]hexane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

433.1824 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 434.18968 203.2
[M+Na]+ 456.17162 218.1
[M+NH4]+ 451.21622 211.0
[M+K]+ 472.14556 206.2
[M-H]- 432.17512 209.3
[M+Na-2H]- 454.15707 212.5
[M]+ 433.18185 207.7
[M]- 433.18295 207.7
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.