CID 43255370

1094887-98-5

Structural Information

Molecular Formula

C₇H₉FN₂O₂S

SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)N)F

InChI

InChI=1S/C7H9FN2O2S/c1-10-13(11,12)7-4-5(9)2-3-6(7)8/h2-4,10H,9H2,1H3

InChIKey

PFEAQGIRENOXFR-UHFFFAOYSA-N

Compound name

5-amino-2-fluoro-N-methylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 24
Patents: 204.03688 Da
Monoisotopic Mass: 0.3
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]+	205.04416	139.8
[M+Na]+	227.02610	149.1
[M+NH4]+	222.07070	146.6
[M+K]+	243.00004	143.1
[M-H]-	203.02960	140.0
[M+Na-2H]-	225.01155	144.6
[M]+	204.03633	141.3
[M]-	204.03743	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe