CID 3046724

4-methoxy-2-(phenylsulfonyl)benzenesulfonic acid hydrazide

Structural Information

Molecular Formula
C13H14N2O5S2
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NNS(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C13H14N2O5S2/c1-20-11-7-9-13(10-8-11)22(18,19)15-14-21(16,17)12-5-3-2-4-6-12/h2-10,14-15H,1H3
InChIKey
AABRBTYEOGHULF-UHFFFAOYSA-N
Compound name
N'-(benzenesulfonyl)-4-methoxybenzenesulfonohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

342.03442 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.04170 174.3
[M+Na]+ 365.02364 181.0
[M-H]- 341.02714 180.2
[M+NH4]+ 360.06824 186.8
[M+K]+ 380.99758 175.7
[M+H-H2O]+ 325.03168 166.4
[M+HCOO]- 387.03262 188.6
[M+CH3COO]- 401.04827 206.6
[M+Na-2H]- 363.00909 181.3
[M]+ 342.03387 177.6
[M]- 342.03497 177.6
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