CID 71504537

3-(6-fluoropyridin-3-yl)phenol

Structural Information

Molecular Formula
C11H8FNO
SMILES
C1=CC(=CC(=C1)O)C2=CN=C(C=C2)F
InChI
InChI=1S/C11H8FNO/c12-11-5-4-9(7-13-11)8-2-1-3-10(14)6-8/h1-7,14H
InChIKey
QYOACMNPGQZEDH-UHFFFAOYSA-N
Compound name
3-(6-fluoropyridin-3-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.05899 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.06627 136.6
[M+Na]+ 212.04821 146.1
[M-H]- 188.05171 140.0
[M+NH4]+ 207.09281 154.4
[M+K]+ 228.02215 141.9
[M+H-H2O]+ 172.05625 128.6
[M+HCOO]- 234.05719 158.4
[M+CH3COO]- 248.07284 149.9
[M+Na-2H]- 210.03366 144.0
[M]+ 189.05844 134.5
[M]- 189.05954 134.5
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

No patent data available for this compound.