CID 22662820

3-fluoropyrazine-2-carboxamide

Structural Information

Molecular Formula
C5H4FN3O
SMILES
C1=CN=C(C(=N1)C(=O)N)F
InChI
InChI=1S/C5H4FN3O/c6-4-3(5(7)10)8-1-2-9-4/h1-2H,(H2,7,10)
InChIKey
KZKNXNNTVCWPDR-UHFFFAOYSA-N
Compound name
3-fluoropyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

141.03384 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.04112 123.7
[M+Na]+ 164.02306 133.1
[M-H]- 140.02656 123.5
[M+NH4]+ 159.06766 142.1
[M+K]+ 179.99700 131.3
[M+H-H2O]+ 124.03110 115.9
[M+HCOO]- 186.03204 145.8
[M+CH3COO]- 200.04769 174.5
[M+Na-2H]- 162.00851 131.0
[M]+ 141.03329 120.8
[M]- 141.03439 120.8
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