CID 10918426

N,n'-diphenylsulfamide

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₂S

SMILES

C1=CC=C(C=C1)NS(=O)(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2S/c15-17(16,13-11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1-10,13-14H

InChIKey

ZDZVWJQUOACMTH-UHFFFAOYSA-N

Compound name

N-(phenylsulfamoyl)aniline

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 890
Patents: 248.06195 Da
Monoisotopic Mass: 2.2
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]+	249.069226	151.3
[M+Na]+	271.051168	158.1
[M-H]-	247.054674	158.0
[M+NH4]+	266.095773	167.9
[M+K]+	287.025108	153.6
[M+H-H2O]+	231.059210	143.8
[M+HCOO]-	293.060151	172.4
[M+CH3COO]-	307.075801	192.5
[M+Na-2H]-	269.036616	159.2
[M]+	248.06140142	151.3
[M]-	248.06249858	151.3

Literature stripe

literature stripe

Patent stripe

patents stripe