CID 165693901

2-fluoro-1-(pyridin-3-yl)ethan-1-ol

Structural Information

Molecular Formula
C7H8FNO
SMILES
C1=CC(=CN=C1)C(CF)O
InChI
InChI=1S/C7H8FNO/c8-4-7(10)6-2-1-3-9-5-6/h1-3,5,7,10H,4H2
InChIKey
JXUKUCPDQHSPJN-UHFFFAOYSA-N
Compound name
2-fluoro-1-pyridin-3-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

141.05899 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.06627 125.7
[M+Na]+ 164.04821 133.3
[M-H]- 140.05171 125.3
[M+NH4]+ 159.09281 145.2
[M+K]+ 180.02215 131.5
[M+H-H2O]+ 124.05625 118.8
[M+HCOO]- 186.05719 146.4
[M+CH3COO]- 200.07284 170.8
[M+Na-2H]- 162.03366 132.8
[M]+ 141.05844 123.2
[M]- 141.05954 123.2
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