CID 78105

P-hydrazinobenzenesulphonamide

Structural Information

Molecular Formula

C₆H₉N₃O₂S

SMILES

C1=CC(=CC=C1NN)S(=O)(=O)N

InChI

InChI=1S/C6H9N3O2S/c7-9-5-1-3-6(4-2-5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)

InChIKey

NBJSNAGTUCWQRO-UHFFFAOYSA-N

Compound name

4-hydrazinylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 45
References: 515
Patents: 187.04155 Da
Monoisotopic Mass: -0.1
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]+	188.04883	134.6
[M+Na]+	210.03077	142.3
[M-H]-	186.03427	137.7
[M+NH4]+	205.07537	153.2
[M+K]+	226.00471	138.9
[M+H-H2O]+	170.03881	128.3
[M+HCOO]-	232.03975	155.4
[M+CH3COO]-	246.05540	183.8
[M+Na-2H]-	208.01622	140.1
[M]+	187.04100	132.3
[M]-	187.04210	132.3

Literature stripe

literature stripe

Patent stripe

patents stripe