CID 21554361

Dichlorofluoro-methanesulfonic acid

Structural Information

Molecular Formula

SMILES

C(F)(S(=O)(=O)O)(Cl)Cl

InChI

InChI=1S/CHCl2FO3S/c2-1(3,4)8(5,6)7/h(H,5,6,7)

InChIKey

IMILTAXUBRRCKD-UHFFFAOYSA-N

Compound name

dichloro(fluoro)methanesulfonic acid

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 24
Patents: 181.90074 Da
Monoisotopic Mass: 0.8
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]+	182.90802	123.0
[M+Na]+	204.88996	133.6
[M-H]-	180.89346	121.7
[M+NH4]+	199.93456	143.9
[M+K]+	220.86390	129.7
[M+H-H2O]+	164.89800	121.2
[M+HCOO]-	226.89894	129.1
[M+CH3COO]-	240.91459	169.9
[M+Na-2H]-	202.87541	128.7
[M]+	181.90019	125.6
[M]-	181.90129	125.6

Literature stripe

literature stripe

Patent stripe

patents stripe