CID 156621183

5,7-dichloro-2,3-dimethylpyrido[3,4-b]pyrazine

Structural Information

Molecular Formula
C9H7Cl2N3
SMILES
CC1=NC2=CC(=NC(=C2N=C1C)Cl)Cl
InChI
InChI=1S/C9H7Cl2N3/c1-4-5(2)13-8-6(12-4)3-7(10)14-9(8)11/h3H,1-2H3
InChIKey
HMSOYCBHMKXNCC-UHFFFAOYSA-N
Compound name
5,7-dichloro-2,3-dimethylpyrido[3,4-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

227.00171 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.00899 143.2
[M+Na]+ 249.99093 156.7
[M-H]- 225.99443 143.6
[M+NH4]+ 245.03553 160.5
[M+K]+ 265.96487 150.7
[M+H-H2O]+ 209.99897 136.3
[M+HCOO]- 271.99991 153.6
[M+CH3COO]- 286.01556 156.1
[M+Na-2H]- 247.97638 150.4
[M]+ 227.00116 147.6
[M]- 227.00226 147.6
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