CID 3040606

5,5-bis(3,4,5-trimethoxyphenyl)hydantoin

Structural Information

Molecular Formula
C21H24N2O8
SMILES
COC1=CC(=CC(=C1OC)OC)C2(C(=O)NC(=O)N2)C3=CC(=C(C(=C3)OC)OC)OC
InChI
InChI=1S/C21H24N2O8/c1-26-13-7-11(8-14(27-2)17(13)30-5)21(19(24)22-20(25)23-21)12-9-15(28-3)18(31-6)16(10-12)29-4/h7-10H,1-6H3,(H2,22,23,24,25)
InChIKey
AWKVMVQFHKHEDD-UHFFFAOYSA-N
Compound name
5,5-bis(3,4,5-trimethoxyphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

432.15326 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.16054 195.8
[M+Na]+ 455.14248 204.4
[M-H]- 431.14598 201.7
[M+NH4]+ 450.18708 205.4
[M+K]+ 471.11642 202.2
[M+H-H2O]+ 415.15052 187.1
[M+HCOO]- 477.15146 212.9
[M+CH3COO]- 491.16711 225.4
[M+Na-2H]- 453.12793 194.3
[M]+ 432.15271 203.6
[M]- 432.15381 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

patents stripe