CID 205365

N-(5-nitro-2-furoyl)urea

Structural Information

Molecular Formula
C6H5N3O5
SMILES
C1=C(OC(=C1)[N+](=O)[O-])C(=O)NC(=O)N
InChI
InChI=1S/C6H5N3O5/c7-6(11)8-5(10)3-1-2-4(14-3)9(12)13/h1-2H,(H3,7,8,10,11)
InChIKey
SYFZLWXALNXYSD-UHFFFAOYSA-N
Compound name
N-carbamoyl-5-nitrofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.02292 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.03020 138.1
[M+Na]+ 222.01214 146.0
[M+NH4]+ 217.05674 143.3
[M+K]+ 237.98608 148.9
[M-H]- 198.01564 140.1
[M+Na-2H]- 219.99759 140.3
[M]+ 199.02237 139.0
[M]- 199.02347 139.0
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.