CID 11207

Methanesulfonyl fluoride

Structural Information

Molecular Formula

SMILES

CS(=O)(=O)F

InChI

InChI=1S/CH3FO2S/c1-5(2,3)4/h1H3

InChIKey

KNWQLFOXPQZGPX-UHFFFAOYSA-N

Compound name

methanesulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 38
References: 5442
Patents: 97.98378 Da
Monoisotopic Mass: 0.1
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]+	98.991056	109.4
[M+Na]+	120.972998	119.6
[M-H]-	96.976504	109.6
[M+NH4]+	116.017603	133.4
[M+K]+	136.946938	119.3
[M+H-H2O]+	80.981040	105.1
[M+HCOO]-	142.981981	127.6
[M+CH3COO]-	156.997631	161.2
[M+Na-2H]-	118.958446	115.5
[M]+	97.98323142	110.7
[M]-	97.98432858	110.7

Literature stripe

literature stripe

Patent stripe

patents stripe