CID 14327414

4003-65-0

Structural Information

Molecular Formula
C10H5Cl3N2O3S
SMILES
C1=CC(=CC=C1N2C(=O)C(=C(C=N2)Cl)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C10H5Cl3N2O3S/c11-8-5-14-15(10(16)9(8)12)6-1-3-7(4-2-6)19(13,17)18/h1-5H
InChIKey
WWYKGUIMLSJYBG-UHFFFAOYSA-N
Compound name
4-(4,5-dichloro-6-oxopyridazin-1-yl)benzenesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

337.90866 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.91594 171.4
[M+Na]+ 360.89788 187.8
[M+NH4]+ 355.94248 178.5
[M+K]+ 376.87182 178.3
[M-H]- 336.90138 172.9
[M+Na-2H]- 358.88333 178.6
[M]+ 337.90811 175.5
[M]- 337.90921 175.5
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