CID 42281362

Pyrido[2,3-b]pyrazine-8-carbaldehyde

Structural Information

Molecular Formula
C8H5N3O
SMILES
C1=CN=C2C(=C1C=O)N=CC=N2
InChI
InChI=1S/C8H5N3O/c12-5-6-1-2-10-8-7(6)9-3-4-11-8/h1-5H
InChIKey
YEGOMKCYWLUVKT-UHFFFAOYSA-N
Compound name
pyrido[2,3-b]pyrazine-8-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

159.04326 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.05054 129.9
[M+Na]+ 182.03248 140.5
[M-H]- 158.03598 130.7
[M+NH4]+ 177.07708 147.7
[M+K]+ 198.00642 137.3
[M+H-H2O]+ 142.04052 121.7
[M+HCOO]- 204.04146 151.1
[M+CH3COO]- 218.05711 143.5
[M+Na-2H]- 180.01793 141.3
[M]+ 159.04271 130.8
[M]- 159.04381 130.8
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