CID 8024487

2-(2-bromophenoxy)-n-methylacetamide

Structural Information

Molecular Formula

C₉H₁₀BrNO₂

SMILES

CNC(=O)COC1=CC=CC=C1Br

InChI

InChI=1S/C9H10BrNO2/c1-11-9(12)6-13-8-5-3-2-4-7(8)10/h2-5H,6H2,1H3,(H,11,12)

InChIKey

HIEWPLFPHYPXIB-UHFFFAOYSA-N

Compound name

2-(2-bromophenoxy)-N-methylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 242.98949 Da
Monoisotopic Mass: 1.8
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]+	243.996766	143.5
[M+Na]+	265.978708	153.9
[M-H]-	241.982214	149.7
[M+NH4]+	261.023313	164.3
[M+K]+	281.952648	143.5
[M+H-H2O]+	225.986750	142.8
[M+HCOO]-	287.987691	166.0
[M+CH3COO]-	302.003341	190.6
[M+Na-2H]-	263.964156	150.9
[M]+	242.98894142	162.9
[M]-	242.99003858	162.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.