CID 9808

2-fluorobenzoyl chloride

Structural Information

Molecular Formula
C7H4ClFO
SMILES
C1=CC=C(C(=C1)C(=O)Cl)F
InChI
InChI=1S/C7H4ClFO/c8-7(10)5-3-1-2-4-6(5)9/h1-4H
InChIKey
RAAGZOYMEQDCTD-UHFFFAOYSA-N
Compound name
2-fluorobenzoyl chloride
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

5332
Patents

157.99347 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.00075 125.5
[M+Na]+ 180.98269 139.2
[M+NH4]+ 176.02729 134.5
[M+K]+ 196.95663 132.4
[M-H]- 156.98619 126.5
[M+Na-2H]- 178.96814 133.1
[M]+ 157.99292 128.0
[M]- 157.99402 128.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe