CID 178244287

2,3-bis(1-oxidopyridin-1-ium-2-yl)pyrazine

Structural Information

Molecular Formula
C14H10N4O2
SMILES
C1=CC=[N+](C(=C1)C2=NC=CN=C2C3=CC=CC=[N+]3[O-])[O-]
InChI
InChI=1S/C14H10N4O2/c19-17-9-3-1-5-11(17)13-14(16-8-7-15-13)12-6-2-4-10-18(12)20/h1-10H
InChIKey
SNLBOSQRZGAHHL-UHFFFAOYSA-N
Compound name
2,3-bis(1-oxidopyridin-1-ium-2-yl)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.08038 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.087656 162.6
[M+Na]+ 289.069598 170.1
[M-H]- 265.073104 165.0
[M+NH4]+ 284.114203 170.5
[M+K]+ 305.043538 154.9
[M+H-H2O]+ 249.077640 160.2
[M+HCOO]- 311.078581 180.1
[M+CH3COO]- 325.094231 179.9
[M+Na-2H]- 287.055046 174.0
[M]+ 266.07983142 156.5
[M]- 266.08092858 156.5
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

No patent data available for this compound.