CID 10308720

2,3-dichloro-n-(3-methoxypyrazin-2-yl)benzenesulfonamide

Structural Information

Molecular Formula
C11H9Cl2N3O3S
SMILES
COC1=NC=CN=C1NS(=O)(=O)C2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C11H9Cl2N3O3S/c1-19-11-10(14-5-6-15-11)16-20(17,18)8-4-2-3-7(12)9(8)13/h2-6H,1H3,(H,14,16)
InChIKey
FLSMVCMSUNISFK-UHFFFAOYSA-N
Compound name
2,3-dichloro-N-(3-methoxypyrazin-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

30
Patents

332.97418 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.98146 166.2
[M+Na]+ 355.96340 177.3
[M-H]- 331.96690 170.9
[M+NH4]+ 351.00800 179.1
[M+K]+ 371.93734 171.2
[M+H-H2O]+ 315.97144 159.4
[M+HCOO]- 377.97238 174.5
[M+CH3COO]- 391.98803 203.6
[M+Na-2H]- 353.94885 171.0
[M]+ 332.97363 173.0
[M]- 332.97473 173.0
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

patents stripe