CID 29539

N-hydroxyphenacetin

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

CCOC1=CC=C(C=C1)N(C(=O)C)O

InChI

InChI=1S/C10H13NO3/c1-3-14-10-6-4-9(5-7-10)11(13)8(2)12/h4-7,13H,3H2,1-2H3

InChIKey

GPMYDZBSYQUDJZ-UHFFFAOYSA-N

Compound name

N-(4-ethoxyphenyl)-N-hydroxyacetamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 17
References: 57
Patents: 195.08954 Da
Monoisotopic Mass: 1.1
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]+	196.096816	141.2
[M+Na]+	218.078758	147.9
[M-H]-	194.082264	145.1
[M+NH4]+	213.123363	160.4
[M+K]+	234.052698	147.8
[M+H-H2O]+	178.086800	134.9
[M+HCOO]-	240.087741	165.4
[M+CH3COO]-	254.103391	186.6
[M+Na-2H]-	216.064206	146.0
[M]+	195.08899142	143.4
[M]-	195.09008858	143.4

Literature stripe

literature stripe

Patent stripe

patents stripe