CID 129294835

Fprse

Structural Information

Molecular Formula

C₅H₆F₇NO₃S

SMILES

C(CO)NS(=O)(=O)C(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C5H6F7NO3S/c6-3(7,4(8,9)10)5(11,12)17(15,16)13-1-2-14/h13-14H,1-2H2

InChIKey

VZNMWWFYPBHICQ-UHFFFAOYSA-N

Compound name

1,1,2,2,3,3,3-heptafluoro-N-(2-hydroxyethyl)propane-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 4
Patents: 292.99567 Da
Monoisotopic Mass: 1.2
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]+	294.00295	148.5
[M+Na]+	315.98489	156.2
[M-H]-	291.98839	138.6
[M+NH4]+	311.02949	162.6
[M+K]+	331.95883	153.2
[M+H-H2O]+	275.99293	138.4
[M+HCOO]-	337.99387	154.1
[M+CH3COO]-	352.00952	195.6
[M+Na-2H]-	313.97034	152.6
[M]+	292.99512	139.9
[M]-	292.99622	139.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe