CID 68194

Sulfamethylthiazole

Structural Information

Molecular Formula

C₁₀H₁₁N₃O₂S₂

SMILES

CC1=CSC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C10H11N3O2S2/c1-7-6-16-10(12-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)

InChIKey

KJVQYDYPDFFJMP-UHFFFAOYSA-N

Compound name

4-amino-N-(4-methyl-1,3-thiazol-2-yl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 617
Patents: 269.02927 Da
Monoisotopic Mass: 0.5
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]+	270.03655	157.0
[M+Na]+	292.01849	166.6
[M+NH4]+	287.06309	164.4
[M+K]+	307.99243	160.0
[M-H]-	268.02199	159.9
[M+Na-2H]-	290.00394	162.8
[M]+	269.02872	159.9
[M]-	269.02982	159.9

Literature stripe

literature stripe

Patent stripe

patents stripe