CID 593569

4-amino-n-(2-methylphenyl)benzenesulfonamide

Structural Information

Molecular Formula

C₁₃H₁₄N₂O₂S

SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C13H14N2O2S/c1-10-4-2-3-5-13(10)15-18(16,17)12-8-6-11(14)7-9-12/h2-9,15H,14H2,1H3

InChIKey

VNBAGPGLMFYJKB-UHFFFAOYSA-N

Compound name

4-amino-N-(2-methylphenyl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 9
Patents: 262.0776 Da
Monoisotopic Mass: 2.0
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]+	263.08488	157.3
[M+Na]+	285.06682	169.5
[M+NH4]+	280.11142	165.3
[M+K]+	301.04076	161.4
[M-H]-	261.07032	161.8
[M+Na-2H]-	283.05227	165.8
[M]+	262.07705	160.7
[M]-	262.07815	160.7

Literature stripe

literature stripe

Patent stripe

patents stripe