CID 45790040

6-chloro-1h,2h,3h,4h-pyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H8ClN3
SMILES
C1CNC2=C(N1)C=CC(=N2)Cl
InChI
InChI=1S/C7H8ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-2,9H,3-4H2,(H,10,11)
InChIKey
CGLFWSRMJVZEGU-UHFFFAOYSA-N
Compound name
6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

169.04068 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.04796 132.8
[M+Na]+ 192.02990 141.3
[M-H]- 168.03340 129.8
[M+NH4]+ 187.07450 149.6
[M+K]+ 208.00384 135.5
[M+H-H2O]+ 152.03794 125.8
[M+HCOO]- 214.03888 143.3
[M+CH3COO]- 228.05453 143.8
[M+Na-2H]- 190.01535 141.1
[M]+ 169.04013 127.9
[M]- 169.04123 127.9
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