CID 13967386

2,3-dichloroquinoxaline-6-sulfonyl chloride

Structural Information

Molecular Formula
C8H3Cl3N2O2S
SMILES
C1=CC2=C(C=C1S(=O)(=O)Cl)N=C(C(=N2)Cl)Cl
InChI
InChI=1S/C8H3Cl3N2O2S/c9-7-8(10)13-6-3-4(16(11,14)15)1-2-5(6)12-7/h1-3H
InChIKey
VZLILCJJQCJIRS-UHFFFAOYSA-N
Compound name
2,3-dichloroquinoxaline-6-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

295.89807 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.90535 151.8
[M+Na]+ 318.88729 164.8
[M-H]- 294.89079 153.4
[M+NH4]+ 313.93189 167.9
[M+K]+ 334.86123 158.9
[M+H-H2O]+ 278.89533 147.5
[M+HCOO]- 340.89627 152.9
[M+CH3COO]- 354.91192 163.6
[M+Na-2H]- 316.87274 157.0
[M]+ 295.89752 157.9
[M]- 295.89862 157.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe