CID 2433221

6-chloro-n-ethyl-n-phenylpyridine-3-sulfonamide

Structural Information

Molecular Formula
C13H13ClN2O2S
SMILES
CCN(C1=CC=CC=C1)S(=O)(=O)C2=CN=C(C=C2)Cl
InChI
InChI=1S/C13H13ClN2O2S/c1-2-16(11-6-4-3-5-7-11)19(17,18)12-8-9-13(14)15-10-12/h3-10H,2H2,1H3
InChIKey
HWBNYAVEICJOTN-UHFFFAOYSA-N
Compound name
6-chloro-N-ethyl-N-phenylpyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

296.03864 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.04592 162.7
[M+Na]+ 319.02786 171.7
[M-H]- 295.03136 169.9
[M+NH4]+ 314.07246 178.3
[M+K]+ 335.00180 166.8
[M+H-H2O]+ 279.03590 155.3
[M+HCOO]- 341.03684 177.1
[M+CH3COO]- 355.05249 201.3
[M+Na-2H]- 317.01331 167.8
[M]+ 296.03809 168.0
[M]- 296.03919 168.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.