CID 5326

Sulfameter

Structural Information

Molecular Formula

C₁₁H₁₂N₄O₃S

SMILES

COC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)

InChIKey

GPTONYMQFTZPKC-UHFFFAOYSA-N

Compound name

4-amino-N-(5-methoxypyrimidin-2-yl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 133
References: 7009
Patents: 280.06302 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]+	281.07030	159.2
[M+Na]+	303.05224	170.8
[M+NH4]+	298.09684	165.2
[M+K]+	319.02618	164.4
[M-H]-	279.05574	161.7
[M+Na-2H]-	301.03769	166.9
[M]+	280.06247	161.8
[M]-	280.06357	161.8

Literature stripe

literature stripe

Patent stripe

patents stripe