CID 6649

80-51-3

Structural Information

Molecular Formula
C12H14N4O5S2
SMILES
C1=CC(=CC=C1OC2=CC=C(C=C2)S(=O)(=O)NN)S(=O)(=O)NN
InChI
InChI=1S/C12H14N4O5S2/c13-15-22(17,18)11-5-1-9(2-6-11)21-10-3-7-12(8-4-10)23(19,20)16-14/h1-8,15-16H,13-14H2
InChIKey
NBOCQTNZUPTTEI-UHFFFAOYSA-N
Compound name
4-[4-(hydrazinesulfonyl)phenoxy]benzenesulfonohydrazide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

20517
Patents

358.04056 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.04784 174.0
[M+Na]+ 381.02978 180.5
[M+NH4]+ 376.07438 178.3
[M+K]+ 397.00372 175.0
[M-H]- 357.03328 176.0
[M+Na-2H]- 379.01523 179.7
[M]+ 358.04001 175.9
[M]- 358.04111 175.9
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