CID 28561351

2-(2-formylphenoxy)-n-methylacetamide

Structural Information

Molecular Formula

C₁₀H₁₁NO₃

SMILES

CNC(=O)COC1=CC=CC=C1C=O

InChI

InChI=1S/C10H11NO3/c1-11-10(13)7-14-9-5-3-2-4-8(9)6-12/h2-6H,7H2,1H3,(H,11,13)

InChIKey

XGBGUOKFVIRIKH-UHFFFAOYSA-N

Compound name

2-(2-formylphenoxy)-N-methylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 193.0739 Da
Monoisotopic Mass: 1.0
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]+	194.08118	140.9
[M+Na]+	216.06312	152.1
[M+NH4]+	211.10772	148.1
[M+K]+	232.03706	146.6
[M-H]-	192.06662	142.3
[M+Na-2H]-	214.04857	146.9
[M]+	193.07335	142.6
[M]-	193.07445	142.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe