CID 2357187

2-cyano-n-(4-sulfamoylphenyl)acetamide

Structural Information

Molecular Formula

C₉H₉N₃O₃S

SMILES

C1=CC(=CC=C1NC(=O)CC#N)S(=O)(=O)N

InChI

InChI=1S/C9H9N3O3S/c10-6-5-9(13)12-7-1-3-8(4-2-7)16(11,14)15/h1-4H,5H2,(H,12,13)(H2,11,14,15)

InChIKey

IQSWUJWQROLSRO-UHFFFAOYSA-N

Compound name

2-cyano-N-(4-sulfamoylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 2
Patents: 239.03647 Da
Monoisotopic Mass: 0.4
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]+	240.04375	150.5
[M+Na]+	262.02569	158.6
[M+NH4]+	257.07029	153.1
[M+K]+	277.99963	150.5
[M-H]-	238.02919	143.7
[M+Na-2H]-	260.01114	152.3
[M]+	239.03592	148.9
[M]-	239.03702	148.9

Literature stripe

literature stripe

Patent stripe

patents stripe