CID 522247

2-(pyrazin-2-yl)ethanol

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1=CN=C(C=N1)CCO
InChI
InChI=1S/C6H8N2O/c9-4-1-6-5-7-2-3-8-6/h2-3,5,9H,1,4H2
InChIKey
MHDJZGMTVSLZDB-UHFFFAOYSA-N
Compound name
2-pyrazin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

197
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 123.3
[M+Na]+ 147.05288 136.4
[M+NH4]+ 142.09748 131.5
[M+K]+ 163.02682 130.3
[M-H]- 123.05638 124.1
[M+Na-2H]- 145.03833 130.9
[M]+ 124.06311 125.3
[M]- 124.06421 125.3
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

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