CID 156324

75198-31-1

Structural Information

Molecular Formula
C11H7N3O3
SMILES
C1=CC2=NC=C(N2C=C1)C3=CC=C(O3)[N+](=O)[O-]
InChI
InChI=1S/C11H7N3O3/c15-14(16)11-5-4-9(17-11)8-7-12-10-3-1-2-6-13(8)10/h1-7H
InChIKey
ZDFULRQJRIJLRF-UHFFFAOYSA-N
Compound name
3-(5-nitrofuran-2-yl)imidazo[1,2-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

72
Patents

229.04874 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.05602 144.7
[M+Na]+ 252.03796 154.5
[M-H]- 228.04146 151.9
[M+NH4]+ 247.08256 162.3
[M+K]+ 268.01190 148.7
[M+H-H2O]+ 212.04600 141.8
[M+HCOO]- 274.04694 170.4
[M+CH3COO]- 288.06259 182.0
[M+Na-2H]- 250.02341 153.9
[M]+ 229.04819 146.8
[M]- 229.04929 146.8
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

patents stripe