CID 67999

Benzoyl fluoride

Structural Information

Molecular Formula
C7H5FO
SMILES
C1=CC=C(C=C1)C(=O)F
InChI
InChI=1S/C7H5FO/c8-7(9)6-4-2-1-3-5-6/h1-5H
InChIKey
HPMLGNIUXVXALD-UHFFFAOYSA-N
Compound name
benzoyl fluoride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

1650
Patents

124.03244 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.03972 119.1
[M+Na]+ 147.02166 127.4
[M-H]- 123.02516 121.8
[M+NH4]+ 142.06626 141.2
[M+K]+ 162.99560 126.1
[M+H-H2O]+ 107.02970 113.1
[M+HCOO]- 169.03064 142.8
[M+CH3COO]- 183.04629 170.0
[M+Na-2H]- 145.00711 126.8
[M]+ 124.03189 117.3
[M]- 124.03299 117.3
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

No patent data available for this compound.