CID 9570756

1-((5-(p-acetamidophenyl)-2-furanyl)methyleneamino)-5-hydroxyhydantoin

Structural Information

Molecular Formula
C16H14N4O5
SMILES
CC(=O)NC1=CC=C(C=C1)C2=CC=C(O2)/C=N/N3C(C(=O)NC3=O)O
InChI
InChI=1S/C16H14N4O5/c1-9(21)18-11-4-2-10(3-5-11)13-7-6-12(25-13)8-17-20-15(23)14(22)19-16(20)24/h2-8,15,23H,1H3,(H,18,21)(H,19,22,24)/b17-8+
InChIKey
JZOPHUCDTLXNJP-CAOOACKPSA-N
Compound name
N-[4-[5-[(E)-(5-hydroxy-2,4-dioxoimidazolidin-1-yl)iminomethyl]furan-2-yl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

342.0964 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.10368 176.3
[M+Na]+ 365.08562 183.3
[M-H]- 341.08912 184.2
[M+NH4]+ 360.13022 187.6
[M+K]+ 381.05956 180.4
[M+H-H2O]+ 325.09366 167.9
[M+HCOO]- 387.09460 197.7
[M+CH3COO]- 401.11025 211.6
[M+Na-2H]- 363.07107 175.7
[M]+ 342.09585 176.2
[M]- 342.09695 176.2
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.