CID 43423271

8-fluoroquinoline-5-sulfonyl chloride

Structural Information

Molecular Formula

C₉H₅ClFNO₂S

SMILES

C1=CC2=C(C=CC(=C2N=C1)F)S(=O)(=O)Cl

InChI

InChI=1S/C9H5ClFNO2S/c10-15(13,14)8-4-3-7(11)9-6(8)2-1-5-12-9/h1-5H

InChIKey

WFHNJMBOSBJIPK-UHFFFAOYSA-N

Compound name

8-fluoroquinoline-5-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 244.97136 Da
Monoisotopic Mass: 2.3
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]+	245.97864	146.0
[M+Na]+	267.96058	160.3
[M+NH4]+	263.00518	154.4
[M+K]+	283.93452	151.5
[M-H]-	243.96408	146.3
[M+Na-2H]-	265.94603	152.6
[M]+	244.97081	148.9
[M]-	244.97191	148.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe