CID 23273907

Quinoline-6-sulfonamide

Structural Information

Molecular Formula

C₉H₈N₂O₂S

SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)N)N=C1

InChI

InChI=1S/C9H8N2O2S/c10-14(12,13)8-3-4-9-7(6-8)2-1-5-11-9/h1-6H,(H2,10,12,13)

InChIKey

ZSJVRUWXJDVHQI-UHFFFAOYSA-N

Compound name

quinoline-6-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 47
Patents: 208.03065 Da
Monoisotopic Mass: 0.6
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]+	209.03793	140.1
[M+Na]+	231.01987	150.1
[M-H]-	207.02337	143.5
[M+NH4]+	226.06447	158.8
[M+K]+	246.99381	146.1
[M+H-H2O]+	191.02791	134.0
[M+HCOO]-	253.02885	157.8
[M+CH3COO]-	267.04450	183.4
[M+Na-2H]-	229.00532	148.1
[M]+	208.03010	141.3
[M]-	208.03120	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe