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]+ 297.045916 162.7
[M+Na]+ 319.027858 171.7
[M-H]- 295.031364 169.9
[M+NH4]+ 314.072463 178.3
[M+K]+ 335.001798 166.8
[M+H-H2O]+ 279.035900 155.3
[M+HCOO]- 341.036841 177.1
[M+CH3COO]- 355.052491 201.3
[M+Na-2H]- 317.013306 167.8
[M]+ 296.03809142 168.0
[M]- 296.03918858 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.