CID 11665644

Quinoline-2-sulfonyl fluoride

Structural Information

Molecular Formula

C₉H₆FNO₂S

SMILES

C1=CC=C2C(=C1)C=CC(=N2)S(=O)(=O)F

InChI

InChI=1S/C9H6FNO2S/c10-14(12,13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H

InChIKey

GNNTZHUFNOYUQO-UHFFFAOYSA-N

Compound name

quinoline-2-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 211.01033 Da
Monoisotopic Mass: 1.9
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]+	212.01761	140.5
[M+Na]+	233.99955	153.8
[M+NH4]+	229.04415	148.8
[M+K]+	249.97349	145.7
[M-H]-	210.00305	140.8
[M+Na-2H]-	231.98500	147.3
[M]+	211.00978	143.0
[M]-	211.01088	143.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe