CID 103439998

1-(bromomethyl)spiro[2.2]pentane

Structural Information

Molecular Formula

SMILES

C1CC12CC2CBr

InChI

InChI=1S/C6H9Br/c7-4-5-3-6(5)1-2-6/h5H,1-4H2

InChIKey

DKEQLSWFBVKMOB-UHFFFAOYSA-N

Compound name

2-(bromomethyl)spiro[2.2]pentane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 159.98875 Da
Monoisotopic Mass: 2.3
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]+	160.99603	102.9
[M+Na]+	182.97797	108.6
[M+NH4]+	178.02257	110.7
[M+K]+	198.95191	110.7
[M-H]-	158.98147	114.6
[M+Na-2H]-	180.96342	113.5
[M]+	159.98820	108.0
[M]-	159.98930	108.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.