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]+ 370.085616 184.5
[M+Na]+ 392.067558 190.6
[M-H]- 368.071064 196.5
[M+NH4]+ 387.112163 196.6
[M+K]+ 408.041498 187.3
[M+H-H2O]+ 352.075600 175.7
[M+HCOO]- 414.076541 207.3
[M+CH3COO]- 428.092191 217.6
[M+Na-2H]- 390.053006 190.1
[M]+ 369.07779142 187.6
[M]- 369.07888858 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.