CID 113204

Pyrazine, methoxymethyl-

Structural Information

Molecular Formula
C6H8N2O
SMILES
COCC1=NC=CN=C1
InChI
InChI=1S/C6H8N2O/c1-9-5-6-4-7-2-3-8-6/h2-4H,5H2,1H3
InChIKey
DXLUAQMRYDUZCJ-UHFFFAOYSA-N
Compound name
2-(methoxymethyl)pyrazine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

236
Patents

124.06366 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 122.2
[M+Na]+ 147.05288 130.9
[M-H]- 123.05638 123.2
[M+NH4]+ 142.09748 141.8
[M+K]+ 163.02682 130.1
[M+H-H2O]+ 107.06092 115.1
[M+HCOO]- 169.06186 145.4
[M+CH3COO]- 183.07751 169.7
[M+Na-2H]- 145.03833 132.2
[M]+ 124.06311 123.5
[M]- 124.06421 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

literature stripe

Patent stripe

patents stripe