CID 122156823

4-oxo-4h-pyrano[2,3-c]pyridine-2-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C9H5NO4
SMILES
C1=CN=CC2=C1C(=O)C=C(O2)C(=O)O
InChI
InChI=1S/C9H5NO4/c11-6-3-7(9(12)13)14-8-4-10-2-1-5(6)8/h1-4H,(H,12,13)
InChIKey
PQYYMLRFQVGPBZ-UHFFFAOYSA-N
Compound name
4-oxopyrano[2,3-c]pyridine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

191.02185 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.02913 134.6
[M+Na]+ 214.01107 148.8
[M+NH4]+ 209.05567 141.9
[M+K]+ 229.98501 144.2
[M-H]- 190.01457 136.6
[M+Na-2H]- 211.99652 140.6
[M]+ 191.02130 137.1
[M]- 191.02240 137.1
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