CID 126782062

2-fluoro-n,3-dimethylbenzene-1-sulfonamide

Structural Information

Molecular Formula

C₈H₁₀FNO₂S

SMILES

CC1=C(C(=CC=C1)S(=O)(=O)NC)F

InChI

InChI=1S/C8H10FNO2S/c1-6-4-3-5-7(8(6)9)13(11,12)10-2/h3-5,10H,1-2H3

InChIKey

PXJRMCHXJXWNJG-UHFFFAOYSA-N

Compound name

2-fluoro-N,3-dimethylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 203.04163 Da
Monoisotopic Mass: 1.4
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]+	204.04891	141.7
[M+Na]+	226.03085	152.4
[M+NH4]+	221.07545	149.1
[M+K]+	242.00479	145.4
[M-H]-	202.03435	141.9
[M+Na-2H]-	224.01630	146.9
[M]+	203.04108	143.6
[M]-	203.04218	143.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.