CID 213236

Brn 2791155

Structural Information

Molecular Formula
C20H12Cl4N2O3
SMILES
C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)Cl)Cl)C(=O)NC3=CC(=C(C=C3)Cl)Cl)O
InChI
InChI=1S/C20H12Cl4N2O3/c21-14-4-2-11(8-16(14)23)25-19(28)10-1-6-18(27)13(7-10)20(29)26-12-3-5-15(22)17(24)9-12/h1-9,27H,(H,25,28)(H,26,29)
InChIKey
SMHANRNSELLJTJ-UHFFFAOYSA-N
Compound name
1-N,3-N-bis(3,4-dichlorophenyl)-4-hydroxybenzene-1,3-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

467.9602 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 468.96748 205.4
[M+Na]+ 490.94942 220.9
[M+NH4]+ 485.99402 212.0
[M+K]+ 506.92336 211.6
[M-H]- 466.95292 210.4
[M+Na-2H]- 488.93487 212.9
[M]+ 467.95965 210.2
[M]- 467.96075 210.2
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.