CID 4729855

6-chloro-n,n-dimethylpyridine-3-sulfonamide

Structural Information

Molecular Formula

C₇H₉ClN₂O₂S

SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)Cl

InChI

InChI=1S/C7H9ClN2O2S/c1-10(2)13(11,12)6-3-4-7(8)9-5-6/h3-5H,1-2H3

InChIKey

ZKZTULWHDVRRJY-UHFFFAOYSA-N

Compound name

6-chloro-N,N-dimethylpyridine-3-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 220.00732 Da
Monoisotopic Mass: 1.0
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]+	221.014596	141.1
[M+Na]+	242.996538	151.1
[M-H]-	219.000044	145.7
[M+NH4]+	238.041143	160.2
[M+K]+	258.970478	148.2
[M+H-H2O]+	203.004580	135.6
[M+HCOO]-	265.005521	155.9
[M+CH3COO]-	279.021171	187.7
[M+Na-2H]-	240.981986	146.3
[M]+	220.00677142	146.5
[M]-	220.00786858	146.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe