CID 149244

Propionamide, 3-(p-(9-acridinylamino)phenyl)-, methanesulfonate

Structural Information

Molecular Formula
C22H19N3O
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CCC(=O)N
InChI
InChI=1S/C22H19N3O/c23-21(26)14-11-15-9-12-16(13-10-15)24-22-17-5-1-3-7-19(17)25-20-8-4-2-6-18(20)22/h1-10,12-13H,11,14H2,(H2,23,26)(H,24,25)
InChIKey
YDAXTCGACADAPH-UHFFFAOYSA-N
Compound name
3-[4-(acridin-9-ylamino)phenyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

341.1528 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.16008 180.0
[M+Na]+ 364.14202 187.6
[M-H]- 340.14552 186.5
[M+NH4]+ 359.18662 192.7
[M+K]+ 380.11596 180.4
[M+H-H2O]+ 324.15006 169.7
[M+HCOO]- 386.15100 201.7
[M+CH3COO]- 400.16665 190.0
[M+Na-2H]- 362.12747 187.9
[M]+ 341.15225 180.0
[M]- 341.15335 180.0
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.