CID 14199080

2h,3h-furo[2,3-c]pyridin-3-one hydrochloride

Structural Information

Molecular Formula
C7H5NO2
SMILES
C1C(=O)C2=C(O1)C=NC=C2
InChI
InChI=1S/C7H5NO2/c9-6-4-10-7-3-8-2-1-5(6)7/h1-3H,4H2
InChIKey
KHRZFVYHKRMYLE-UHFFFAOYSA-N
Compound name
furo[2,3-c]pyridin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

135.03203 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.039306 121.0
[M+Na]+ 158.021248 131.0
[M-H]- 134.024754 125.3
[M+NH4]+ 153.065853 143.2
[M+K]+ 173.995188 130.5
[M+H-H2O]+ 118.029290 115.5
[M+HCOO]- 180.030231 144.0
[M+CH3COO]- 194.045881 136.3
[M+Na-2H]- 156.006696 130.2
[M]+ 135.03148142 122.0
[M]- 135.03257858 122.0
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