CID 2755398

5,6-dibromo-1-hexene

Structural Information

Molecular Formula

C₆H₁₀Br₂

SMILES

C=CCCC(CBr)Br

InChI

InChI=1S/C6H10Br2/c1-2-3-4-6(8)5-7/h2,6H,1,3-5H2

InChIKey

WFGDPUOTONXJOS-UHFFFAOYSA-N

Compound name

5,6-dibromohex-1-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 39
Patents: 239.91493 Da
Monoisotopic Mass: 3.3
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]+	240.922206	133.3
[M+Na]+	262.904148	143.7
[M-H]-	238.907654	137.4
[M+NH4]+	257.948753	154.3
[M+K]+	278.878088	128.1
[M+H-H2O]+	222.912190	141.6
[M+HCOO]-	284.913131	148.7
[M+CH3COO]-	298.928781	197.0
[M+Na-2H]-	260.889596	140.1
[M]+	239.91438142	166.7
[M]-	239.91547858	166.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe