CID 9578422

Brn 1019612

Structural Information

Molecular Formula
C10H12N4O5
SMILES
C1COCCN1C(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-]
InChI
InChI=1S/C10H12N4O5/c15-10(13-3-5-18-6-4-13)12-11-7-8-1-2-9(19-8)14(16)17/h1-2,7H,3-6H2,(H,12,15)/b11-7+
InChIKey
NVAUCWNDTOEUTI-YRNVUSSQSA-N
Compound name
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]morpholine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

268.08078 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.08806 157.0
[M+Na]+ 291.07000 165.6
[M+NH4]+ 286.11460 162.3
[M+K]+ 307.04394 167.0
[M-H]- 267.07350 162.6
[M+Na-2H]- 289.05545 160.3
[M]+ 268.08023 159.1
[M]- 268.08133 159.1
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.