CID 60448

110465-03-7

Structural Information

Molecular Formula
C26H34N4O4
SMILES
CCN1C(=O)C(N(C1=O)CC(CN2CCN(CC2)CCO)O)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H34N4O4/c1-2-29-24(33)26(21-9-5-3-6-10-21,22-11-7-4-8-12-22)30(25(29)34)20-23(32)19-28-15-13-27(14-16-28)17-18-31/h3-12,23,31-32H,2,13-20H2,1H3
InChIKey
ALDMCFDPLMWCEE-UHFFFAOYSA-N
Compound name
3-ethyl-1-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

466.258 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.26528 215.1
[M+Na]+ 489.24722 217.7
[M-H]- 465.25072 218.8
[M+NH4]+ 484.29182 219.0
[M+K]+ 505.22116 211.3
[M+H-H2O]+ 449.25526 202.5
[M+HCOO]- 511.25620 223.1
[M+CH3COO]- 525.27185 230.6
[M+Na-2H]- 487.23267 209.8
[M]+ 466.25745 210.9
[M]- 466.25855 210.9
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.