CID 4246943

7-bromopyrido[2,3-b]pyrazine

Structural Information

Molecular Formula
C7H4BrN3
SMILES
C1=CN=C2C(=N1)C=C(C=N2)Br
InChI
InChI=1S/C7H4BrN3/c8-5-3-6-7(11-4-5)10-2-1-9-6/h1-4H
InChIKey
YEDMUIQRKXNDQI-UHFFFAOYSA-N
Compound name
7-bromopyrido[2,3-b]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

208.95886 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.96614 130.8
[M+Na]+ 231.94808 144.5
[M-H]- 207.95158 134.5
[M+NH4]+ 226.99268 150.6
[M+K]+ 247.92202 133.4
[M+H-H2O]+ 191.95612 130.0
[M+HCOO]- 253.95706 149.9
[M+CH3COO]- 267.97271 146.2
[M+Na-2H]- 229.93353 143.8
[M]+ 208.95831 149.5
[M]- 208.95941 149.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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