CID 9574263

Akos024399604

Structural Information

Molecular Formula
C18H15N3O4S
SMILES
C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CO3
InChI
InChI=1S/C18H15N3O4S/c22-18(20-19-13-16-5-4-12-25-16)14-8-10-15(11-9-14)21-26(23,24)17-6-2-1-3-7-17/h1-13,21H,(H,20,22)/b19-13+
InChIKey
QVXFKLPGKMKTIJ-CPNJWEJPSA-N
Compound name
4-(benzenesulfonamido)-N-[(E)-furan-2-ylmethylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.07834 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.08562 184.5
[M+Na]+ 392.06756 190.6
[M-H]- 368.07106 196.5
[M+NH4]+ 387.11216 196.6
[M+K]+ 408.04150 187.3
[M+H-H2O]+ 352.07560 175.7
[M+HCOO]- 414.07654 207.3
[M+CH3COO]- 428.09219 217.6
[M+Na-2H]- 390.05301 190.1
[M]+ 369.07779 187.6
[M]- 369.07889 187.6
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.