CID 67708

Dibromochlorofluoromethane

Structural Information

Molecular Formula

SMILES

C(F)(Cl)(Br)Br

InChI

InChI=1S/CBr2ClF/c2-1(3,4)5

InChIKey

HEDKQVNHJZBFQR-UHFFFAOYSA-N

Compound name

dibromo-chloro-fluoromethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 66
Patents: 223.80392 Da
Monoisotopic Mass: 2.9
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]+	224.81120	124.9
[M+Na]+	246.79314	138.4
[M-H]-	222.79664	128.8
[M+NH4]+	241.83774	147.3
[M+K]+	262.76708	121.8
[M+H-H2O]+	206.80118	134.2
[M+HCOO]-	268.80212	136.6
[M+CH3COO]-	282.81777	190.9
[M+Na-2H]-	244.77859	134.3
[M]+	223.80337	157.9
[M]-	223.80447	157.9

Literature stripe

literature stripe

Patent stripe

patents stripe