CID 89453241

(2-bromoethoxy)cyclopropane

Structural Information

Molecular Formula

SMILES

C1CC1OCCBr

InChI

InChI=1S/C5H9BrO/c6-3-4-7-5-1-2-5/h5H,1-4H2

InChIKey

PUDYLBJWZUNZOR-UHFFFAOYSA-N

Compound name

2-bromoethoxycyclopropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 163.98367 Da
Monoisotopic Mass: 1.4
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]+	164.990946	128.4
[M+Na]+	186.972888	141.4
[M-H]-	162.976394	135.7
[M+NH4]+	182.017493	148.1
[M+K]+	202.946828	131.5
[M+H-H2O]+	146.980930	128.3
[M+HCOO]-	208.981871	150.6
[M+CH3COO]-	222.997521	179.3
[M+Na-2H]-	184.958336	137.4
[M]+	163.98312142	149.2
[M]-	163.98421858	149.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe