CID 14480057

29183-14-0

Structural Information

Molecular Formula

C₁₀H₁₃NO₂

SMILES

CC1=C(C(=CC=C1)C)NC(=O)CO

InChI

InChI=1S/C10H13NO2/c1-7-4-3-5-8(2)10(7)11-9(13)6-12/h3-5,12H,6H2,1-2H3,(H,11,13)

InChIKey

LUIJJBHAVXGCTP-UHFFFAOYSA-N

Compound name

N-(2,6-dimethylphenyl)-2-hydroxyacetamide

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 4
Patents: 179.09464 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]+	180.101916	138.1
[M+Na]+	202.083858	145.7
[M-H]-	178.087364	140.9
[M+NH4]+	197.128463	157.6
[M+K]+	218.057798	143.6
[M+H-H2O]+	162.091900	132.5
[M+HCOO]-	224.092841	161.5
[M+CH3COO]-	238.108491	182.2
[M+Na-2H]-	200.069306	142.9
[M]+	179.09409142	137.9
[M]-	179.09518858	137.9

Literature stripe

literature stripe

Patent stripe

patents stripe