CID 2758778

2-ethoxypyrazine

Structural Information

Molecular Formula
C6H8N2O
SMILES
CCOC1=NC=CN=C1
InChI
InChI=1S/C6H8N2O/c1-2-9-6-5-7-3-4-8-6/h3-5H,2H2,1H3
InChIKey
ATIUKJHILQVQLE-UHFFFAOYSA-N
Compound name
2-ethoxypyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

361
Patents

124.06366 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.070936 122.2
[M+Na]+ 147.052878 130.9
[M-H]- 123.056384 123.2
[M+NH4]+ 142.097483 141.8
[M+K]+ 163.026818 130.1
[M+H-H2O]+ 107.060920 115.1
[M+HCOO]- 169.061861 145.4
[M+CH3COO]- 183.077511 169.7
[M+Na-2H]- 145.038326 132.2
[M]+ 124.06311142 123.5
[M]- 124.06420858 123.5
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.