CID 3058209

5,5-bis(3-hydroxymethyl-4-methoxyphenyl)hydantoin

Structural Information

Molecular Formula
C19H20N2O6
SMILES
COC1=C(C=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC(=C(C=C3)OC)CO)CO
InChI
InChI=1S/C19H20N2O6/c1-26-15-5-3-13(7-11(15)9-22)19(17(24)20-18(25)21-19)14-4-6-16(27-2)12(8-14)10-23/h3-8,22-23H,9-10H2,1-2H3,(H2,20,21,24,25)
InChIKey
ITRRQSUTLLSHSX-UHFFFAOYSA-N
Compound name
5,5-bis[3-(hydroxymethyl)-4-methoxyphenyl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.13214 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.13942 185.1
[M+Na]+ 395.12136 192.8
[M-H]- 371.12486 188.0
[M+NH4]+ 390.16596 195.5
[M+K]+ 411.09530 187.4
[M+H-H2O]+ 355.12940 177.0
[M+HCOO]- 417.13034 199.7
[M+CH3COO]- 431.14599 208.0
[M+Na-2H]- 393.10681 184.3
[M]+ 372.13159 185.0
[M]- 372.13269 185.0
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.