CID 33729028

7-bromo-2,3-dichloropyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H2BrCl2N3
SMILES
C1=C(C=NC2=C1N=C(C(=N2)Cl)Cl)Br
InChI
InChI=1S/C7H2BrCl2N3/c8-3-1-4-7(11-2-3)13-6(10)5(9)12-4/h1-2H
InChIKey
XOXWPDIAPAYCKK-UHFFFAOYSA-N
Compound name
7-bromo-2,3-dichloropyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

276.88092 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.88820 138.1
[M+Na]+ 299.87014 154.7
[M-H]- 275.87364 141.4
[M+NH4]+ 294.91474 157.0
[M+K]+ 315.84408 140.9
[M+H-H2O]+ 259.87818 138.1
[M+HCOO]- 321.87912 147.6
[M+CH3COO]- 335.89477 153.1
[M+Na-2H]- 297.85559 148.6
[M]+ 276.88037 159.7
[M]- 276.88147 159.7
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