CID 62150516

2-amino-n-phenylquinoline-6-sulfonamide

Structural Information

Molecular Formula

C₁₅H₁₃N₃O₂S

SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3)N

InChI

InChI=1S/C15H13N3O2S/c16-15-9-6-11-10-13(7-8-14(11)17-15)21(19,20)18-12-4-2-1-3-5-12/h1-10,18H,(H2,16,17)

InChIKey

FWOTWWNOSVMUSL-UHFFFAOYSA-N

Compound name

2-amino-N-phenylquinoline-6-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 299.07285 Da
Monoisotopic Mass: 2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	300.080126	164.3
[M+Na]+	322.062068	173.0
[M-H]-	298.065574	170.3
[M+NH4]+	317.106673	178.5
[M+K]+	338.036008	167.0
[M+H-H2O]+	282.070110	156.2
[M+HCOO]-	344.071051	182.3
[M+CH3COO]-	358.086701	175.5
[M+Na-2H]-	320.047516	172.3
[M]+	299.07230142	164.6
[M]-	299.07339858	164.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.