CID 11275846

Ethyl 2-(2-bromoethoxy)acetate

Structural Information

Molecular Formula

C₆H₁₁BrO₃

SMILES

CCOC(=O)COCCBr

InChI

InChI=1S/C6H11BrO3/c1-2-10-6(8)5-9-4-3-7/h2-5H2,1H3

InChIKey

WNMJBBFBTADHCL-UHFFFAOYSA-N

Compound name

ethyl 2-(2-bromoethoxy)acetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 209.98917 Da
Monoisotopic Mass: 1.1
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]+	210.99645	137.7
[M+Na]+	232.97839	138.6
[M+NH4]+	228.02299	141.3
[M+K]+	248.95233	139.6
[M-H]-	208.98189	135.2
[M+Na-2H]-	230.96384	138.1
[M]+	209.98862	135.7
[M]-	209.98972	135.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe