CID 213234

P-isophthalophenetidide, 4-hydroxy-

Structural Information

Molecular Formula
C24H24N2O5
SMILES
CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)O)C(=O)NC3=CC=C(C=C3)OCC
InChI
InChI=1S/C24H24N2O5/c1-3-30-19-10-6-17(7-11-19)25-23(28)16-5-14-22(27)21(15-16)24(29)26-18-8-12-20(13-9-18)31-4-2/h5-15,27H,3-4H2,1-2H3,(H,25,28)(H,26,29)
InChIKey
BXTGBULAJKITBA-UHFFFAOYSA-N
Compound name
1-N,3-N-bis(4-ethoxyphenyl)-4-hydroxybenzene-1,3-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.16852 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.17580 200.8
[M+Na]+ 443.15774 204.8
[M-H]- 419.16124 208.9
[M+NH4]+ 438.20234 208.8
[M+K]+ 459.13168 201.1
[M+H-H2O]+ 403.16578 190.1
[M+HCOO]- 465.16672 222.7
[M+CH3COO]- 479.18237 230.0
[M+Na-2H]- 441.14319 201.5
[M]+ 420.16797 203.1
[M]- 420.16907 203.1
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.