CID 15475344

2-(pyrimidin-4-yl)ethanol

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1=CN=CN=C1CCO
InChI
InChI=1S/C6H8N2O/c9-4-2-6-1-3-7-5-8-6/h1,3,5,9H,2,4H2
InChIKey
BOVUIYOURRNFKZ-UHFFFAOYSA-N
Compound name
2-pyrimidin-4-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

124.06366 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 123.0
[M+Na]+ 147.05288 131.3
[M-H]- 123.05638 122.6
[M+NH4]+ 142.09748 141.9
[M+K]+ 163.02682 129.5
[M+H-H2O]+ 107.06092 116.2
[M+HCOO]- 169.06186 144.7
[M+CH3COO]- 183.07751 167.0
[M+Na-2H]- 145.03833 132.5
[M]+ 124.06311 122.4
[M]- 124.06421 122.4
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