CID 9578422

15970-86-2

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 156.9
[M+Na]+ 291.07000 160.1
[M-H]- 267.07350 164.3
[M+NH4]+ 286.11460 169.3
[M+K]+ 307.04394 157.3
[M+H-H2O]+ 251.07804 152.9
[M+HCOO]- 313.07898 180.3
[M+CH3COO]- 327.09463 192.3
[M+Na-2H]- 289.05545 164.7
[M]+ 268.08023 154.0
[M]- 268.08133 154.0
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.