CID 152954

28129-90-0

Structural Information

Molecular Formula
C15H14N2O4
SMILES
C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC(C(C=C3)O)O
InChI
InChI=1S/C15H14N2O4/c18-11-7-6-10(8-12(11)19)15(9-4-2-1-3-5-9)13(20)16-14(21)17-15/h1-8,11-12,18-19H,(H2,16,17,20,21)
InChIKey
FEEKFEKCXIDMIS-UHFFFAOYSA-N
Compound name
5-(3,4-dihydroxycyclohexa-1,5-dien-1-yl)-5-phenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

42
Patents

286.09537 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.10265 164.8
[M+Na]+ 309.08459 172.2
[M-H]- 285.08809 167.3
[M+NH4]+ 304.12919 178.5
[M+K]+ 325.05853 166.0
[M+H-H2O]+ 269.09263 157.3
[M+HCOO]- 331.09357 179.2
[M+CH3COO]- 345.10922 174.4
[M+Na-2H]- 307.07004 165.9
[M]+ 286.09482 158.3
[M]- 286.09592 158.3
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.