CID 363213

Nsc627891

Structural Information

Molecular Formula
C21H17N3O3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N=NC=C2C3=CC=CC=C3N(C4=CC=CC=C42)O
InChI
InChI=1S/C21H17N3O3S/c1-15-10-12-16(13-11-15)28(26,27)23-22-14-19-17-6-2-4-8-20(17)24(25)21-9-5-3-7-18(19)21/h2-14,25H,1H3
InChIKey
QMZPDKUVPPMLGH-UHFFFAOYSA-N
Compound name
N-[(10-hydroxyacridin-9-ylidene)methylimino]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.09906 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.10634 189.6
[M+Na]+ 414.08828 198.2
[M-H]- 390.09178 197.7
[M+NH4]+ 409.13288 201.9
[M+K]+ 430.06222 191.8
[M+H-H2O]+ 374.09632 180.0
[M+HCOO]- 436.09726 206.3
[M+CH3COO]- 450.11291 199.5
[M+Na-2H]- 412.07373 197.3
[M]+ 391.09851 192.6
[M]- 391.09961 192.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.