CID 2773331

4-bromo-2-fluorobenzamide

Structural Information

Molecular Formula

SMILES

C1=CC(=C(C=C1Br)F)C(=O)N

InChI

InChI=1S/C7H5BrFNO/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H2,10,11)

InChIKey

MJDRFCPNHLHNON-UHFFFAOYSA-N

Compound name

4-bromo-2-fluorobenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 364
Patents: 216.95386 Da
Monoisotopic Mass: 1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	217.96114	137.1
[M+Na]+	239.94308	139.5
[M+NH4]+	234.98768	141.4
[M+K]+	255.91702	140.0
[M-H]-	215.94658	136.7
[M+Na-2H]-	237.92853	140.0
[M]+	216.95331	135.9
[M]-	216.95441	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe