CID 86697561

6-chloro-1,2-dihydropyrido[2,3-b]pyrazin-3(4h)-one

Structural Information

Molecular Formula
C7H6ClN3O
SMILES
C1C(=O)NC2=C(N1)C=CC(=N2)Cl
InChI
InChI=1S/C7H6ClN3O/c8-5-2-1-4-7(10-5)11-6(12)3-9-4/h1-2,9H,3H2,(H,10,11,12)
InChIKey
KMJARQBZUOZMQM-UHFFFAOYSA-N
Compound name
6-chloro-2,4-dihydro-1H-pyrido[2,3-b]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

183.01994 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.02722 134.7
[M+Na]+ 206.00916 148.6
[M+NH4]+ 201.05376 142.7
[M+K]+ 221.98310 142.1
[M-H]- 182.01266 134.8
[M+Na-2H]- 203.99461 140.2
[M]+ 183.01939 136.8
[M]- 183.02049 136.8
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