CID 31296

Chlorodibromomethane

Structural Information

Molecular Formula

SMILES

C(Cl)(Br)Br

InChI

InChI=1S/CHBr2Cl/c2-1(3)4/h1H

InChIKey

GATVIKZLVQHOMN-UHFFFAOYSA-N

Compound name

dibromo(chloro)methane

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 212
References: 3390
Patents: 205.81335 Da
Monoisotopic Mass: 2.6
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]+	206.820626	119.0
[M+Na]+	228.802568	132.0
[M-H]-	204.806074	123.8
[M+NH4]+	223.847173	141.9
[M+K]+	244.776508	115.9
[M+H-H2O]+	188.810610	128.8
[M+HCOO]-	250.811551	132.0
[M+CH3COO]-	264.827201	189.3
[M+Na-2H]-	226.788016	127.9
[M]+	205.81280142	152.8
[M]-	205.81389858	152.8

Literature stripe

literature stripe

Patent stripe

patents stripe