CID 15657925

Ethyl 3-hydroxy-5-methylpyrazine-2-carboxylate

Structural Information

Molecular Formula
C8H10N2O3
SMILES
CCOC(=O)C1=NC=C(NC1=O)C
InChI
InChI=1S/C8H10N2O3/c1-3-13-8(12)6-7(11)10-5(2)4-9-6/h4H,3H2,1-2H3,(H,10,11)
InChIKey
LZJZHTZAUNNQGU-UHFFFAOYSA-N
Compound name
ethyl 6-methyl-2-oxo-1H-pyrazine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

182.06914 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.076416 135.8
[M+Na]+ 205.058358 145.4
[M-H]- 181.061864 136.1
[M+NH4]+ 200.102963 152.8
[M+K]+ 221.032298 143.4
[M+H-H2O]+ 165.066400 129.0
[M+HCOO]- 227.067341 156.7
[M+CH3COO]- 241.082991 178.0
[M+Na-2H]- 203.043806 141.5
[M]+ 182.06859142 137.5
[M]- 182.06968858 137.5
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

patents stripe