CID 59583

N-(2-bromoallyl)-2-bromoacetamide

Structural Information

Molecular Formula

C₅H₇Br₂NO

SMILES

C=C(CNC(=O)CBr)Br

InChI

InChI=1S/C5H7Br2NO/c1-4(7)3-8-5(9)2-6/h1-3H2,(H,8,9)

InChIKey

DBDWCAOPFYAKDV-UHFFFAOYSA-N

Compound name

2-bromo-N-(2-bromoprop-2-enyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 254.88943 Da
Monoisotopic Mass: 1.5
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]+	255.89671	141.1
[M+Na]+	277.87865	134.4
[M+NH4]+	272.92325	142.5
[M+K]+	293.85259	141.6
[M-H]-	253.88215	140.3
[M+Na-2H]-	275.86410	141.0
[M]+	254.88888	138.6
[M]-	254.88998	138.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.