CID 72462

Chlorsulfaquinoxaline

Structural Information

Molecular Formula
C14H11ClN4O2S
SMILES
C1=CC2=NC(=CN=C2C(=C1)Cl)NS(=O)(=O)C3=CC=C(C=C3)N
InChI
InChI=1S/C14H11ClN4O2S/c15-11-2-1-3-12-14(11)17-8-13(18-12)19-22(20,21)10-6-4-9(16)5-7-10/h1-8H,16H2,(H,18,19)
InChIKey
CTSNHMQGVWXIEG-UHFFFAOYSA-N
Compound name
4-amino-N-(5-chloroquinoxalin-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

21
References

8393
Patents

334.0291 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.03638 171.2
[M+Na]+ 357.01832 181.8
[M-H]- 333.02182 176.4
[M+NH4]+ 352.06292 183.9
[M+K]+ 372.99226 174.6
[M+H-H2O]+ 317.02636 163.5
[M+HCOO]- 379.02730 183.7
[M+CH3COO]- 393.04295 182.0
[M+Na-2H]- 355.00377 178.6
[M]+ 334.02855 174.2
[M]- 334.02965 174.2
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