CID 7147142

6-amino-n-methylpyridine-3-sulfonamide

Structural Information

Molecular Formula

C₆H₉N₃O₂S

SMILES

CNS(=O)(=O)C1=CN=C(C=C1)N

InChI

InChI=1S/C6H9N3O2S/c1-8-12(10,11)5-2-3-6(7)9-4-5/h2-4,8H,1H3,(H2,7,9)

InChIKey

WHHNEWLNYCKFQR-UHFFFAOYSA-N

Compound name

6-amino-N-methylpyridine-3-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 187.04155 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]+	188.048826	135.8
[M+Na]+	210.030768	144.6
[M-H]-	186.034274	138.3
[M+NH4]+	205.075373	153.9
[M+K]+	226.004708	141.5
[M+H-H2O]+	170.038810	129.4
[M+HCOO]-	232.039751	155.2
[M+CH3COO]-	246.055401	181.8
[M+Na-2H]-	208.016216	142.0
[M]+	187.04100142	135.9
[M]-	187.04209858	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe