CID 9554238

5-hydroxy-1-((5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2-furanyl)methyleneamino)hydantoin

Structural Information

Molecular Formula
C15H10F3N3O4
SMILES
C1=CC(=CC(=C1)C(F)(F)F)C2=CC=C(O2)/C=N/N3C(C(=O)NC3=O)O
InChI
InChI=1S/C15H10F3N3O4/c16-15(17,18)9-3-1-2-8(6-9)11-5-4-10(25-11)7-19-21-13(23)12(22)20-14(21)24/h1-7,13,23H,(H,20,22,24)/b19-7+
InChIKey
YFXHJOOGCZHBBQ-FBCYGCLPSA-N
Compound name
5-hydroxy-1-[(E)-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylideneamino]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

353.06235 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.06963 174.3
[M+Na]+ 376.05157 183.6
[M-H]- 352.05507 178.4
[M+NH4]+ 371.09617 185.8
[M+K]+ 392.02551 179.3
[M+H-H2O]+ 336.05961 164.4
[M+HCOO]- 398.06055 190.9
[M+CH3COO]- 412.07620 209.0
[M+Na-2H]- 374.03702 173.9
[M]+ 353.06180 170.8
[M]- 353.06290 170.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.