CID 43456677

2-chloroquinoline-6-sulfonamide

Structural Information

Molecular Formula

C₉H₇ClN₂O₂S

SMILES

C1=CC2=C(C=CC(=N2)Cl)C=C1S(=O)(=O)N

InChI

InChI=1S/C9H7ClN2O2S/c10-9-4-1-6-5-7(15(11,13)14)2-3-8(6)12-9/h1-5H,(H2,11,13,14)

InChIKey

HXNLGTKENNXLJI-UHFFFAOYSA-N

Compound name

2-chloroquinoline-6-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 241.99167 Da
Monoisotopic Mass: 1.5
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]+	242.99895	147.5
[M+Na]+	264.98089	161.4
[M+NH4]+	260.02549	156.1
[M+K]+	280.95483	153.1
[M-H]-	240.98439	149.5
[M+Na-2H]-	262.96634	154.2
[M]+	241.99112	150.8
[M]-	241.99222	150.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe