CID 2743364

N'-[(dimethylamino)methylidene]benzenesulfonohydrazide

Structural Information

Molecular Formula

C₉H₁₃N₃O₂S

SMILES

CN(C)C=NNS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H13N3O2S/c1-12(2)8-10-11-15(13,14)9-6-4-3-5-7-9/h3-8,11H,1-2H3

InChIKey

XGXZGTOFLKZQHB-UHFFFAOYSA-N

Compound name

N'-(benzenesulfonamido)-N,N-dimethylmethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 227.07285 Da
Monoisotopic Mass: 0.9
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]+	228.080126	147.4
[M+Na]+	250.062068	153.9
[M-H]-	226.065574	153.8
[M+NH4]+	245.106673	166.1
[M+K]+	266.036008	152.4
[M+H-H2O]+	210.070110	140.0
[M+HCOO]-	272.071051	170.8
[M+CH3COO]-	286.086701	197.1
[M+Na-2H]-	248.047516	154.0
[M]+	227.07230142	150.3
[M]-	227.07339858	150.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.