CID 58420857

1-pyrazin-2-ylethenol

Structural Information

Molecular Formula
C6H6N2O
SMILES
C=C(C1=NC=CN=C1)O
InChI
InChI=1S/C6H6N2O/c1-5(9)6-4-7-2-3-8-6/h2-4,9H,1H2
InChIKey
IULKLRLLNQEPIZ-UHFFFAOYSA-N
Compound name
1-pyrazin-2-ylethenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

122.04801 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.055286 122.1
[M+Na]+ 145.037228 130.5
[M-H]- 121.040734 121.8
[M+NH4]+ 140.081833 140.9
[M+K]+ 161.011168 128.5
[M+H-H2O]+ 105.045270 115.5
[M+HCOO]- 167.046211 143.0
[M+CH3COO]- 181.061861 166.9
[M+Na-2H]- 143.022676 130.4
[M]+ 122.04746142 120.1
[M]- 122.04855858 120.1
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