CID 139023266

2-[(3-methylbut-2-en-1-yl)oxy]pyrazine

Structural Information

Molecular Formula
C9H12N2O
SMILES
CC(=CCOC1=NC=CN=C1)C
InChI
InChI=1S/C9H12N2O/c1-8(2)3-6-12-9-7-10-4-5-11-9/h3-5,7H,6H2,1-2H3
InChIKey
FYCLGBBFHGLWAA-UHFFFAOYSA-N
Compound name
2-(3-methylbut-2-enoxy)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.09496 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 135.3
[M+Na]+ 187.084178 142.9
[M-H]- 163.087684 135.9
[M+NH4]+ 182.128783 153.2
[M+K]+ 203.058118 141.1
[M+H-H2O]+ 147.092220 127.8
[M+HCOO]- 209.093161 156.7
[M+CH3COO]- 223.108811 178.0
[M+Na-2H]- 185.069626 142.5
[M]+ 164.09441142 136.3
[M]- 164.09550858 136.3
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.