CID 155858626

2580227-93-4

Structural Information

Molecular Formula

C₁₀H₁₉Br

SMILES

CC(C)(C)CC1CC(C1)CBr

InChI

InChI=1S/C10H19Br/c1-10(2,3)6-8-4-9(5-8)7-11/h8-9H,4-7H2,1-3H3

InChIKey

CBSMTSHWEBIOKL-UHFFFAOYSA-N

Compound name

1-(bromomethyl)-3-(2,2-dimethylpropyl)cyclobutane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 218.06702 Da
Monoisotopic Mass: 4.3
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]+	219.07430	143.7
[M+Na]+	241.05624	141.9
[M+NH4]+	236.10084	145.7
[M+K]+	257.03018	143.3
[M-H]-	217.05974	141.4
[M+Na-2H]-	239.04169	143.5
[M]+	218.06647	140.7
[M]-	218.06757	140.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.