CID 132371478

5-aminonaphthalene-2-sulfonyl fluoride hydrochloride

Structural Information

Molecular Formula

C₁₀H₈FNO₂S

SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)F)C(=C1)N

InChI

InChI=1S/C10H8FNO2S/c11-15(13,14)8-4-5-9-7(6-8)2-1-3-10(9)12/h1-6H,12H2

InChIKey

JRNYPRZNAXNTAC-UHFFFAOYSA-N

Compound name

5-aminonaphthalene-2-sulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 225.02597 Da
Monoisotopic Mass: 2.3
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]+	226.033246	142.2
[M+Na]+	248.015188	152.6
[M-H]-	224.018694	145.7
[M+NH4]+	243.059793	161.7
[M+K]+	263.989128	148.1
[M+H-H2O]+	208.023230	135.8
[M+HCOO]-	270.024171	159.6
[M+CH3COO]-	284.039821	187.6
[M+Na-2H]-	246.000636	148.5
[M]+	225.02542142	142.5
[M]-	225.02651858	142.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.