CID 11029901

4-fluoro-2-hydroxybenzonitrile

Structural Information

Molecular Formula
C7H4FNO
SMILES
C1=CC(=C(C=C1F)O)C#N
InChI
InChI=1S/C7H4FNO/c8-6-2-1-5(4-9)7(10)3-6/h1-3,10H
InChIKey
ZAYFMRICIYQIAP-UHFFFAOYSA-N
Compound name
4-fluoro-2-hydroxybenzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

186
Patents

137.0277 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.03498 126.4
[M+Na]+ 160.01692 138.8
[M+NH4]+ 155.06152 131.2
[M+K]+ 175.99086 129.5
[M-H]- 136.02042 119.7
[M+Na-2H]- 158.00237 130.5
[M]+ 137.02715 125.3
[M]- 137.02825 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

No literature data available for this compound.

Patent stripe

patents stripe