CID 3073325

4h-pyrano(3,2-b)pyridin-4-one, 2-(2-pyridinyl)-

Structural Information

Molecular Formula
C13H8N2O2
SMILES
C1=CC=NC(=C1)C2=CC(=O)C3=C(O2)C=CC=N3
InChI
InChI=1S/C13H8N2O2/c16-10-8-12(9-4-1-2-6-14-9)17-11-5-3-7-15-13(10)11/h1-8H
InChIKey
YIGAQRQWFYUGJJ-UHFFFAOYSA-N
Compound name
2-pyridin-2-ylpyrano[3,2-b]pyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.05858 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.06586 146.1
[M+Na]+ 247.04780 156.9
[M-H]- 223.05130 152.2
[M+NH4]+ 242.09240 161.1
[M+K]+ 263.02174 153.4
[M+H-H2O]+ 207.05584 136.9
[M+HCOO]- 269.05678 167.5
[M+CH3COO]- 283.07243 159.5
[M+Na-2H]- 245.03325 157.0
[M]+ 224.05803 147.9
[M]- 224.05913 147.9
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.