CID 101820

643-25-4

Structural Information

Molecular Formula
C6H9ClN4O4S2
SMILES
C1=C(C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)N)NN
InChI
InChI=1S/C6H9ClN4O4S2/c7-3-1-4(11-8)6(17(10,14)15)2-5(3)16(9,12)13/h1-2,11H,8H2,(H2,9,12,13)(H2,10,14,15)
InChIKey
ICQGVVKEPCRPDJ-UHFFFAOYSA-N
Compound name
4-chloro-6-hydrazinylbenzene-1,3-disulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.97537 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.98265 162.6
[M+Na]+ 322.96459 168.5
[M+NH4]+ 318.00919 167.2
[M+K]+ 338.93853 163.6
[M-H]- 298.96809 162.2
[M+Na-2H]- 320.95004 164.6
[M]+ 299.97482 163.9
[M]- 299.97592 163.9
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

No patent data available for this compound.