CID 15370858

1993-10-8

Structural Information

Molecular Formula

C₆H₆F₂N₂O₂S

SMILES

C1=C(C(=CC(=C1F)F)S(=O)(=O)N)N

InChI

InChI=1S/C6H6F2N2O2S/c7-3-1-5(9)6(2-4(3)8)13(10,11)12/h1-2H,9H2,(H2,10,11,12)

InChIKey

PQSIISBSDXDVLD-UHFFFAOYSA-N

Compound name

2-amino-4,5-difluorobenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 208.01181 Da
Monoisotopic Mass: 0.6
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]+	209.01909	135.5
[M+Na]+	231.00103	145.9
[M-H]-	207.00453	136.6
[M+NH4]+	226.04563	154.1
[M+K]+	246.97497	141.8
[M+H-H2O]+	191.00907	128.2
[M+HCOO]-	253.01001	153.3
[M+CH3COO]-	267.02566	186.5
[M+Na-2H]-	228.98648	138.1
[M]+	208.01126	132.6
[M]-	208.01236	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe