CID 4739091

Pyrido[2,3-b]pyrazine-6-carboxylic acid

Structural Information

Molecular Formula
C8H5N3O2
SMILES
C1=CC(=NC2=NC=CN=C21)C(=O)O
InChI
InChI=1S/C8H5N3O2/c12-8(13)6-2-1-5-7(11-6)10-4-3-9-5/h1-4H,(H,12,13)
InChIKey
HOBUKUYGYYLBAA-UHFFFAOYSA-N
Compound name
pyrido[2,3-b]pyrazine-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

175.03818 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.04546 133.6
[M+Na]+ 198.02740 143.4
[M-H]- 174.03090 133.2
[M+NH4]+ 193.07200 149.9
[M+K]+ 214.00134 140.3
[M+H-H2O]+ 158.03544 125.7
[M+HCOO]- 220.03638 152.5
[M+CH3COO]- 234.05203 146.2
[M+Na-2H]- 196.01285 143.4
[M]+ 175.03763 133.5
[M]- 175.03873 133.5
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.