CID 106441

2-isopropyl-6-methoxypyrazine

Structural Information

Molecular Formula
C8H12N2O
SMILES
CC(C)C1=CN=CC(=N1)OC
InChI
InChI=1S/C8H12N2O/c1-6(2)7-4-9-5-8(10-7)11-3/h4-6H,1-3H3
InChIKey
QFGMXPJWRJAIMB-UHFFFAOYSA-N
Compound name
2-methoxy-6-propan-2-ylpyrazine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

130
Patents

152.09496 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.10224 131.6
[M+Na]+ 175.08418 144.9
[M+NH4]+ 170.12878 139.7
[M+K]+ 191.05812 139.1
[M-H]- 151.08768 132.7
[M+Na-2H]- 173.06963 138.8
[M]+ 152.09441 133.8
[M]- 152.09551 133.8
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

patents stripe