CID 118753524

Chembl3544501

Structural Information

Molecular Formula
C16H14N2O4
SMILES
COC1=C(C=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=CC=C3)O
InChI
InChI=1S/C16H14N2O4/c1-22-13-8-7-11(9-12(13)19)16(10-5-3-2-4-6-10)14(20)17-15(21)18-16/h2-9,19H,1H3,(H2,17,18,20,21)
InChIKey
YVSBYIZXRZXLKX-UHFFFAOYSA-N
Compound name
5-(3-hydroxy-4-methoxyphenyl)-5-phenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.09537 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.10265 168.6
[M+Na]+ 321.08459 180.8
[M+NH4]+ 316.12919 175.5
[M+K]+ 337.05853 175.5
[M-H]- 297.08809 170.6
[M+Na-2H]- 319.07004 176.1
[M]+ 298.09482 170.7
[M]- 298.09592 170.7
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.