CID 12826106

Furo[2,3-c]pyridine-7(6h)-one

Structural Information

Molecular Formula
C7H5NO2
SMILES
C1=CNC(=O)C2=C1C=CO2
InChI
InChI=1S/C7H5NO2/c9-7-6-5(1-3-8-7)2-4-10-6/h1-4H,(H,8,9)
InChIKey
SHSNAKRNZGOTJL-UHFFFAOYSA-N
Compound name
6H-furo[2,3-c]pyridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

135.03203 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.03931 119.2
[M+Na]+ 158.02125 130.8
[M-H]- 134.02475 122.8
[M+NH4]+ 153.06585 140.9
[M+K]+ 173.99519 129.0
[M+H-H2O]+ 118.02929 114.0
[M+HCOO]- 180.03023 143.5
[M+CH3COO]- 194.04588 134.9
[M+Na-2H]- 156.00670 129.8
[M]+ 135.03148 121.3
[M]- 135.03258 121.3
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

patents stripe