CID 33135

2-ethyl-3-methoxypyrazine

Structural Information

Molecular Formula
C7H10N2O
SMILES
CCC1=NC=CN=C1OC
InChI
InChI=1S/C7H10N2O/c1-3-6-7(10-2)9-5-4-8-6/h4-5H,3H2,1-2H3
InChIKey
DPCILIMHENXHQX-UHFFFAOYSA-N
Compound name
2-ethyl-3-methoxypyrazine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1
References

387
Patents

138.07932 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.08660 126.6
[M+Na]+ 161.06854 135.9
[M-H]- 137.07204 127.8
[M+NH4]+ 156.11314 146.0
[M+K]+ 177.04248 134.8
[M+H-H2O]+ 121.07658 119.6
[M+HCOO]- 183.07752 149.4
[M+CH3COO]- 197.09317 173.8
[M+Na-2H]- 159.05399 135.3
[M]+ 138.07877 128.6
[M]- 138.07987 128.6
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