CID 3022156

Brn 5617211

Structural Information

Molecular Formula
C14H12N2O6S
SMILES
C1=CC(=CC=C1NC(=O)C(=O)NS(=O)(=O)C2=CC=C(C=C2)O)O
InChI
InChI=1S/C14H12N2O6S/c17-10-3-1-9(2-4-10)15-13(19)14(20)16-23(21,22)12-7-5-11(18)6-8-12/h1-8,17-18H,(H,15,19)(H,16,20)
InChIKey
XCONFUIFSNWJNC-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)-N'-(4-hydroxyphenyl)sulfonyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.0416 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.04888 171.4
[M+Na]+ 359.03082 176.9
[M-H]- 335.03432 175.5
[M+NH4]+ 354.07542 182.7
[M+K]+ 375.00476 173.2
[M+H-H2O]+ 319.03886 163.8
[M+HCOO]- 381.03980 187.7
[M+CH3COO]- 395.05545 203.8
[M+Na-2H]- 357.01627 175.0
[M]+ 336.04105 171.9
[M]- 336.04215 171.9
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.