CID 2366506

N-(3-chloroquinoxalin-2-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Structural Information

Molecular Formula
C16H12ClN3O4S
SMILES
C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=NC4=CC=CC=C4N=C3Cl
InChI
InChI=1S/C16H12ClN3O4S/c17-15-16(19-12-4-2-1-3-11(12)18-15)20-25(21,22)10-5-6-13-14(9-10)24-8-7-23-13/h1-6,9H,7-8H2,(H,19,20)
InChIKey
FLYSTJPGXIHABX-UHFFFAOYSA-N
Compound name
N-(3-chloroquinoxalin-2-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

377.0237 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.03098 179.7
[M+Na]+ 400.01292 189.5
[M-H]- 376.01642 186.8
[M+NH4]+ 395.05752 189.1
[M+K]+ 415.98686 186.1
[M+H-H2O]+ 360.02096 171.2
[M+HCOO]- 422.02190 186.9
[M+CH3COO]- 436.03755 189.8
[M+Na-2H]- 397.99837 188.9
[M]+ 377.02315 184.9
[M]- 377.02425 184.9
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.