CID 640834

6-chloropyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H4ClN3
SMILES
C1=CC(=NC2=NC=CN=C21)Cl
InChI
InChI=1S/C7H4ClN3/c8-6-2-1-5-7(11-6)10-4-3-9-5/h1-4H
InChIKey
WHKACFUJNYOJPD-UHFFFAOYSA-N
Compound name
6-chloropyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

52
Patents

165.00937 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.01665 128.6
[M+Na]+ 187.99859 145.6
[M+NH4]+ 183.04319 138.2
[M+K]+ 203.97253 137.4
[M-H]- 164.00209 130.8
[M+Na-2H]- 185.98404 138.0
[M]+ 165.00882 132.1
[M]- 165.00992 132.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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