CID 43532703

2-fluoro-n-(1h-pyrazol-4-yl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C9H8FN3O2S
SMILES
C1=CC=C(C(=C1)F)S(=O)(=O)NC2=CNN=C2
InChI
InChI=1S/C9H8FN3O2S/c10-8-3-1-2-4-9(8)16(14,15)13-7-5-11-12-6-7/h1-6,13H,(H,11,12)
InChIKey
KMIBJPIYOXRHFL-UHFFFAOYSA-N
Compound name
2-fluoro-N-(1H-pyrazol-4-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.03212 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.039396 147.7
[M+Na]+ 264.021338 157.4
[M-H]- 240.024844 150.1
[M+NH4]+ 259.065943 163.9
[M+K]+ 279.995278 152.5
[M+H-H2O]+ 224.029380 139.8
[M+HCOO]- 286.030321 164.6
[M+CH3COO]- 300.045971 185.1
[M+Na-2H]- 262.006786 152.3
[M]+ 241.03157142 146.9
[M]- 241.03266858 146.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.