CID 385776

Nsc677170

Structural Information

Molecular Formula
C20H16N4O4S
SMILES
C1=CC=C2C(=C1)C(=O)C3=C(N2)C(=CC=C3)C(=O)NNC4=CC=C(C=C4)S(=O)(=O)N
InChI
InChI=1S/C20H16N4O4S/c21-29(27,28)13-10-8-12(9-11-13)23-24-20(26)16-6-3-5-15-18(16)22-17-7-2-1-4-14(17)19(15)25/h1-11,23H,(H,22,25)(H,24,26)(H2,21,27,28)
InChIKey
VPWINEMCRWFENM-UHFFFAOYSA-N
Compound name
4-[2-(9-oxo-10H-acridine-4-carbonyl)hydrazinyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

408.08923 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.09651 188.5
[M+Na]+ 431.07845 196.8
[M-H]- 407.08195 194.2
[M+NH4]+ 426.12305 198.0
[M+K]+ 447.05239 190.1
[M+H-H2O]+ 391.08649 179.8
[M+HCOO]- 453.08743 204.8
[M+CH3COO]- 467.10308 197.4
[M+Na-2H]- 429.06390 197.5
[M]+ 408.08868 189.9
[M]- 408.08978 189.9
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.