CID 55252766

6-chloro-4-methyl-1h,2h,3h,4h-pyrido[2,3-b]pyrazin-2-one

Structural Information

Molecular Formula
C8H8ClN3O
SMILES
CN1CC(=O)NC2=C1N=C(C=C2)Cl
InChI
InChI=1S/C8H8ClN3O/c1-12-4-7(13)10-5-2-3-6(9)11-8(5)12/h2-3H,4H2,1H3,(H,10,13)
InChIKey
XWNWOOKEOAQUGP-UHFFFAOYSA-N
Compound name
6-chloro-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.03558 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.04286 139.6
[M+Na]+ 220.02480 150.2
[M-H]- 196.02830 138.7
[M+NH4]+ 215.06940 156.4
[M+K]+ 235.99874 145.0
[M+H-H2O]+ 180.03284 132.5
[M+HCOO]- 242.03378 151.6
[M+CH3COO]- 256.04943 151.5
[M+Na-2H]- 218.01025 146.3
[M]+ 197.03503 138.4
[M]- 197.03613 138.4
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.