CID 20351916

1-naphthalenesulfonyl fluoride

Structural Information

Molecular Formula

C₁₀H₇FO₂S

SMILES

C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)F

InChI

InChI=1S/C10H7FO2S/c11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H

InChIKey

MYKMYBMCWFRCHA-UHFFFAOYSA-N

Compound name

naphthalene-1-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 210.01508 Da
Monoisotopic Mass: 2.9
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]+	211.02236	140.7
[M+Na]+	233.00430	154.0
[M+NH4]+	228.04890	149.7
[M+K]+	248.97824	145.4
[M-H]-	209.00780	141.8
[M+Na-2H]-	230.98975	147.8
[M]+	210.01453	143.5
[M]-	210.01563	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe