CID 15149672

88394-06-3

Structural Information

Molecular Formula
C6H7N3O2
SMILES
CC1=CNC(=O)C(=N1)C(=O)N
InChI
InChI=1S/C6H7N3O2/c1-3-2-8-6(11)4(9-3)5(7)10/h2H,1H3,(H2,7,10)(H,8,11)
InChIKey
WUPAWCXFTGKASP-UHFFFAOYSA-N
Compound name
5-methyl-2-oxo-1H-pyrazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

153.05383 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.06111 128.9
[M+Na]+ 176.04305 138.5
[M-H]- 152.04655 128.9
[M+NH4]+ 171.08765 146.4
[M+K]+ 192.01699 135.9
[M+H-H2O]+ 136.05109 122.2
[M+HCOO]- 198.05203 150.6
[M+CH3COO]- 212.06768 174.9
[M+Na-2H]- 174.02850 134.8
[M]+ 153.05328 126.7
[M]- 153.05438 126.7
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

patents stripe