CID 84766

Phenol, 2,2'-sulfonylbis-

Structural Information

Molecular Formula
C12H10O4S
SMILES
C1=CC=C(C(=C1)O)S(=O)(=O)C2=CC=CC=C2O
InChI
InChI=1S/C12H10O4S/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14/h1-8,13-14H
InChIKey
QUWAJPZDCZDTJS-UHFFFAOYSA-N
Compound name
2-(2-hydroxyphenyl)sulfonylphenol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

10572
Patents

250.02998 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.03726 152.0
[M+Na]+ 273.01920 165.2
[M+NH4]+ 268.06380 159.5
[M+K]+ 288.99314 158.1
[M-H]- 249.02270 154.3
[M+Na-2H]- 271.00465 159.8
[M]+ 250.02943 155.0
[M]- 250.03053 155.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe