CID 5356

Sultiame

Structural Information

Molecular Formula

C₁₀H₁₄N₂O₄S₂

SMILES

C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C10H14N2O4S2/c11-18(15,16)10-5-3-9(4-6-10)12-7-1-2-8-17(12,13)14/h3-6H,1-2,7-8H2,(H2,11,15,16)

InChIKey

HMHVCUVYZFYAJI-UHFFFAOYSA-N

Compound name

4-(1,1-dioxothiazinan-2-yl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 174
References: 7303
Patents: 290.0395 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]+	291.046776	160.0
[M+Na]+	313.028718	167.7
[M-H]-	289.032224	164.0
[M+NH4]+	308.073323	175.6
[M+K]+	329.002658	162.7
[M+H-H2O]+	273.036760	153.8
[M+HCOO]-	335.037701	169.6
[M+CH3COO]-	349.053351	194.0
[M+Na-2H]-	311.014166	163.8
[M]+	290.03895142	158.9
[M]-	290.04004858	158.9

Literature stripe

literature stripe

Patent stripe

patents stripe