CID 135647

Methanesulfonanilide, 2'-(9-acridinylamino)-n-methyl-, hydrochloride

Structural Information

Molecular Formula
C21H19N3O2S
SMILES
CN(C1=CC=CC=C1NC2=C3C=CC=CC3=NC4=CC=CC=C42)S(=O)(=O)C
InChI
InChI=1S/C21H19N3O2S/c1-24(27(2,25)26)20-14-8-7-13-19(20)23-21-15-9-3-5-11-17(15)22-18-12-6-4-10-16(18)21/h3-14H,1-2H3,(H,22,23)
InChIKey
YRKAETCECNTJBU-UHFFFAOYSA-N
Compound name
N-[2-(acridin-9-ylamino)phenyl]-N-methylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

377.1198 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.12708 186.4
[M+Na]+ 400.10902 195.3
[M-H]- 376.11252 194.9
[M+NH4]+ 395.15362 199.2
[M+K]+ 416.08296 189.5
[M+H-H2O]+ 360.11706 176.8
[M+HCOO]- 422.11800 204.3
[M+CH3COO]- 436.13365 196.9
[M+Na-2H]- 398.09447 195.3
[M]+ 377.11925 191.3
[M]- 377.12035 191.3
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.