CID 20360823

35252-02-9

Structural Information

Molecular Formula
C7H5N3O
SMILES
C1=CC2=C(NC(=O)C=N2)N=C1
InChI
InChI=1S/C7H5N3O/c11-6-4-9-5-2-1-3-8-7(5)10-6/h1-4H,(H,8,10,11)
InChIKey
LMJJEQQMLOQOON-UHFFFAOYSA-N
Compound name
4H-pyrido[2,3-b]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

331
Patents

147.04326 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.05054 126.4
[M+Na]+ 170.03248 137.1
[M-H]- 146.03598 126.0
[M+NH4]+ 165.07708 144.1
[M+K]+ 186.00642 133.1
[M+H-H2O]+ 130.04052 118.8
[M+HCOO]- 192.04146 146.4
[M+CH3COO]- 206.05711 139.7
[M+Na-2H]- 168.01793 137.8
[M]+ 147.04271 125.2
[M]- 147.04381 125.2
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