CID 18183913

2-(4-hydroxyphenoxy)-n-methylacetamide

Structural Information

Molecular Formula

C₉H₁₁NO₃

SMILES

CNC(=O)COC1=CC=C(C=C1)O

InChI

InChI=1S/C9H11NO3/c1-10-9(12)6-13-8-4-2-7(11)3-5-8/h2-5,11H,6H2,1H3,(H,10,12)

InChIKey

DJVAYQMSFWMJAN-UHFFFAOYSA-N

Compound name

2-(4-hydroxyphenoxy)-N-methylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 181.0739 Da
Monoisotopic Mass: 0.7
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]+	182.08118	137.7
[M+Na]+	204.06312	148.5
[M+NH4]+	199.10772	144.9
[M+K]+	220.03706	143.6
[M-H]-	180.06662	138.8
[M+Na-2H]-	202.04857	143.4
[M]+	181.07335	139.2
[M]-	181.07445	139.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe