CID 279869

N-(4-bromophenyl)pyrazine-2-carboxamide

Structural Information

Molecular Formula
C11H8BrN3O
SMILES
C1=CC(=CC=C1NC(=O)C2=NC=CN=C2)Br
InChI
InChI=1S/C11H8BrN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-7H,(H,15,16)
InChIKey
PMHLUGKKASKOBF-UHFFFAOYSA-N
Compound name
N-(4-bromophenyl)pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

276.98508 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.99236 149.2
[M+Na]+ 299.97430 159.9
[M-H]- 275.97780 155.8
[M+NH4]+ 295.01890 165.7
[M+K]+ 315.94824 148.1
[M+H-H2O]+ 259.98234 146.9
[M+HCOO]- 321.98328 169.9
[M+CH3COO]- 335.99893 195.3
[M+Na-2H]- 297.95975 158.5
[M]+ 276.98453 166.7
[M]- 276.98563 166.7
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

No patent data available for this compound.