CID 78396

2-hydroxyphenacetin

Structural Information

Molecular Formula

C₁₀H₁₃NO₃

SMILES

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

InChI

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

InChIKey

CFLMLQJYYALAPD-UHFFFAOYSA-N

Compound name

N-(4-ethoxy-2-hydroxyphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 47
Patents: 195.08954 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]+	196.09682	141.0
[M+Na]+	218.07876	148.5
[M-H]-	194.08226	143.8
[M+NH4]+	213.12336	159.8
[M+K]+	234.05270	147.0
[M+H-H2O]+	178.08680	135.1
[M+HCOO]-	240.08774	164.7
[M+CH3COO]-	254.10339	184.4
[M+Na-2H]-	216.06421	145.8
[M]+	195.08899	142.3
[M]-	195.09009	142.3

Literature stripe

literature stripe

Patent stripe

patents stripe