CID 222491

Cyclohexanesulfonyl fluoride

Structural Information

Molecular Formula

C₆H₁₁FO₂S

SMILES

C1CCC(CC1)S(=O)(=O)F

InChI

InChI=1S/C6H11FO2S/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2

InChIKey

AZEGOLOUIMTJRU-UHFFFAOYSA-N

Compound name

cyclohexanesulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 66
Patents: 166.04637 Da
Monoisotopic Mass: 2.0
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]+	167.05365	130.5
[M+Na]+	189.03559	137.1
[M-H]-	165.03909	132.4
[M+NH4]+	184.08019	151.3
[M+K]+	205.00953	135.4
[M+H-H2O]+	149.04363	124.8
[M+HCOO]-	211.04457	144.7
[M+CH3COO]-	225.06022	172.6
[M+Na-2H]-	187.02104	134.1
[M]+	166.04582	127.2
[M]-	166.04692	127.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe