CID 24835387

3-idrazino-1,2,4-benzotiadiazina-1,1-diossido [italian]

Structural Information

Molecular Formula

C₇H₈N₄O₂S

SMILES

C1=CC=C2C(=C1)NC(=NS2(=O)=O)NN

InChI

InChI=1S/C7H8N4O2S/c8-10-7-9-5-3-1-2-4-6(5)14(12,13)11-7/h1-4H,8H2,(H2,9,10,11)

InChIKey

WEZVWNMDSNVKGL-UHFFFAOYSA-N

Compound name

(1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-yl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 212.0368 Da
Monoisotopic Mass: -0.6
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]+	213.04408	139.0
[M+Na]+	235.02602	149.9
[M+NH4]+	230.07062	147.6
[M+K]+	250.99996	141.5
[M-H]-	211.02952	140.2
[M+Na-2H]-	233.01147	145.8
[M]+	212.03625	141.1
[M]-	212.03735	141.1

Literature stripe

literature stripe

Patent stripe

patents stripe