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

19
Patents

159.04326 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.050536 129.9
[M+Na]+ 182.032478 140.5
[M-H]- 158.035984 130.7
[M+NH4]+ 177.077083 147.7
[M+K]+ 198.006418 137.3
[M+H-H2O]+ 142.040520 121.7
[M+HCOO]- 204.041461 151.1
[M+CH3COO]- 218.057111 143.5
[M+Na-2H]- 180.017926 141.3
[M]+ 159.04271142 130.8
[M]- 159.04380858 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