CID 152602

Methanesulfonamide, 1-(p-(9-acridinylamino)phenyl)-

Structural Information

Molecular Formula
C20H17N3O2S
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CS(=O)(=O)N
InChI
InChI=1S/C20H17N3O2S/c21-26(24,25)13-14-9-11-15(12-10-14)22-20-16-5-1-3-7-18(16)23-19-8-4-2-6-17(19)20/h1-12H,13H2,(H,22,23)(H2,21,24,25)
InChIKey
QPLRHBSMCAJLGG-UHFFFAOYSA-N
Compound name
[4-(acridin-9-ylamino)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

363.10416 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.111436 181.4
[M+Na]+ 386.093378 190.9
[M-H]- 362.096884 188.3
[M+NH4]+ 381.137983 194.1
[M+K]+ 402.067318 183.6
[M+H-H2O]+ 346.101420 172.5
[M+HCOO]- 408.102361 198.7
[M+CH3COO]- 422.118011 191.7
[M+Na-2H]- 384.078826 190.7
[M]+ 363.10361142 184.0
[M]- 363.10470858 184.0
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.