CID 3076358

130889-51-9

Structural Information

Molecular Formula
C24H19ClN2O4
SMILES
C1=CC=C(C=C1)C2(C(=O)N(C(=O)N2CC3=CC=C(C=C3)Cl)CC(=O)O)C4=CC=CC=C4
InChI
InChI=1S/C24H19ClN2O4/c25-20-13-11-17(12-14-20)15-27-23(31)26(16-21(28)29)22(30)24(27,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,28,29)
InChIKey
FNASBGMDWYKYTN-UHFFFAOYSA-N
Compound name
2-[3-[(4-chlorophenyl)methyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

434.10333 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.11061 201.7
[M+Na]+ 457.09255 210.0
[M-H]- 433.09605 210.9
[M+NH4]+ 452.13715 211.6
[M+K]+ 473.06649 202.6
[M+H-H2O]+ 417.10059 191.1
[M+HCOO]- 479.10153 214.6
[M+CH3COO]- 493.11718 210.5
[M+Na-2H]- 455.07800 200.1
[M]+ 434.10278 203.6
[M]- 434.10388 203.6
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.