CID 80641

6337-56-0

Structural Information

Molecular Formula

C₁₀H₁₃NO₂

SMILES

CC1=CC(=CC(=C1NC(=O)C)C)O

InChI

InChI=1S/C10H13NO2/c1-6-4-9(13)5-7(2)10(6)11-8(3)12/h4-5,13H,1-3H3,(H,11,12)

InChIKey

IZHSFKZROSCMKK-UHFFFAOYSA-N

Compound name

N-(4-hydroxy-2,6-dimethylphenyl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 10
References: 6
Patents: 179.09464 Da
Monoisotopic Mass: 0.3
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]+	180.10192	137.5
[M+Na]+	202.08386	146.1
[M-H]-	178.08736	140.7
[M+NH4]+	197.12846	157.4
[M+K]+	218.05780	144.0
[M+H-H2O]+	162.09190	132.2
[M+HCOO]-	224.09284	160.9
[M+CH3COO]-	238.10849	183.5
[M+Na-2H]-	200.06931	141.6
[M]+	179.09409	137.8
[M]-	179.09519	137.8

Literature stripe

literature stripe

Patent stripe

patents stripe