CID 6321387

Nifurdazil

Structural Information

Molecular Formula
C10H12N4O5
SMILES
C1CN(C(=O)N1CCO)/N=C/C2=CC=C(O2)[N+](=O)[O-]
InChI
InChI=1S/C10H12N4O5/c15-6-5-12-3-4-13(10(12)16)11-7-8-1-2-9(19-8)14(17)18/h1-2,7,15H,3-6H2/b11-7+
InChIKey
VDDRCCQKLVNYHQ-YRNVUSSQSA-N
Compound name
1-(2-hydroxyethyl)-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]imidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1062
Patents

268.08078 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.08806 156.7
[M+Na]+ 291.07000 162.7
[M-H]- 267.07350 162.0
[M+NH4]+ 286.11460 171.1
[M+K]+ 307.04394 158.0
[M+H-H2O]+ 251.07804 153.4
[M+HCOO]- 313.07898 180.3
[M+CH3COO]- 327.09463 189.9
[M+Na-2H]- 289.05545 161.7
[M]+ 268.08023 156.0
[M]- 268.08133 156.0
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.