CID 77230570

8-chloropyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H4ClN3
SMILES
C1=CN=C2C(=C1Cl)N=CC=N2
InChI
InChI=1S/C7H4ClN3/c8-5-1-2-10-7-6(5)9-3-4-11-7/h1-4H
InChIKey
JVLXOXUSFFORHY-UHFFFAOYSA-N
Compound name
8-chloropyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

165.00937 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.01665 128.2
[M+Na]+ 187.99859 139.6
[M-H]- 164.00209 128.7
[M+NH4]+ 183.04319 146.7
[M+K]+ 203.97253 135.2
[M+H-H2O]+ 148.00663 120.6
[M+HCOO]- 210.00757 144.5
[M+CH3COO]- 224.02322 141.8
[M+Na-2H]- 185.98404 139.7
[M]+ 165.00882 129.8
[M]- 165.00992 129.8
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