CID 10352643

2-bromo-n-(2-methoxyethyl)acetamide

Structural Information

Molecular Formula

C₅H₁₀BrNO₂

SMILES

COCCNC(=O)CBr

InChI

InChI=1S/C5H10BrNO2/c1-9-3-2-7-5(8)4-6/h2-4H2,1H3,(H,7,8)

InChIKey

RLXVBFBDUXSRQW-UHFFFAOYSA-N

Compound name

2-bromo-N-(2-methoxyethyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 72
Patents: 194.98949 Da
Monoisotopic Mass: -0.2
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]+	195.99677	133.4
[M+Na]+	217.97871	143.6
[M-H]-	193.98221	136.4
[M+NH4]+	213.02331	155.9
[M+K]+	233.95265	134.0
[M+H-H2O]+	177.98675	133.2
[M+HCOO]-	239.98769	155.5
[M+CH3COO]-	254.00334	182.7
[M+Na-2H]-	215.96416	140.9
[M]+	194.98894	153.1
[M]-	194.99004	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe