CID 518838

2-ethenyl-6-methylpyrazine

Structural Information

Molecular Formula
C7H8N2
SMILES
CC1=CN=CC(=N1)C=C
InChI
InChI=1S/C7H8N2/c1-3-7-5-8-4-6(2)9-7/h3-5H,1H2,2H3
InChIKey
KZXOOWGVLDEHDT-UHFFFAOYSA-N
Compound name
2-ethenyl-6-methylpyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

261
Patents

120.06875 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.07603 123.1
[M+Na]+ 143.05797 137.5
[M+NH4]+ 138.10257 131.8
[M+K]+ 159.03191 130.4
[M-H]- 119.06147 124.7
[M+Na-2H]- 141.04342 131.2
[M]+ 120.06820 125.6
[M]- 120.06930 125.6
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